Cas no 79-08-3 (to ntu)

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Product Name:to ntu
CAS No:79-08-3
MF:C2H3BrO2
MW:138.948020219803
MDL:MFCD00002678
CID:34156
PubChem ID:6227
Update Time:2024-10-27

to ntu Chemical and Physical Properties

Names and Identifiers

    • Bromoacetic acid in ethyleneglycol
    • MBAA
    • Monobromoacetic acid
    • Bromoacetic acid
    • Aceticacid,bromo-
    • Acide bromacetique
    • alpha-Bromoethanoic acid
    • Bromaceticacid
    • bromoacetateion
    • bromoacetic
    • 2-Bromoacetic acid
    • Bromoacetic acid solution
    • α-Bromoacetic acid
    • 2-Bromoethanoic acid
    • alpha-Bromoacetic acid
    • 2-Bromo acetic acid
    • 2B3HS32431
    • UN 1938
    • FT-0700929
    • C2H3BrO2
    • AKOS000118919
    • D05DOM
    • Caswell No. 112A
    • Bromoacetic acid, ReagentPlus(R), >=99.0%
    • DTXCID601495
    • LS-1770
    • BDBM50119693
    • BROMOACETIC ACID [MI]
    • Q421323
    • Bromoacetic acid, purum, >=98.0% (T)
    • B0531
    • bromacetic acid
    • Acetic acid, 2-bromo-
    • SCHEMBL23032
    • C2-H3-Br-O2
    • Bromoacetic acid, ReagentPlus(R), >=99%
    • LMFA01090074
    • Bromoacetic acid-13C2
    • Bromoethanoic acid
    • 2-bromo-acetic acid
    • STL481895
    • Bromoacetic acid, solid
    • Bromoacetic acid-2-13C
    • HSDB 7627
    • Bromoacetic acid 1000 microg/mL in Methyl-tert-butyl ether
    • BROMOACETIC-13C2ACID
    • FT-0772262
    • .alpha.-Bromoacetic acid
    • Kyselina bromoctova [Czech]
    • NCGC00091467-02
    • BROMOACETIC ACID [HSDB]
    • EC 201-175-8
    • CHEMBL60851
    • Acide bromacetique [French]
    • Bromo-acetic acid
    • 44 - Haloacetic Acids
    • UN1938
    • NSC141
    • DTXSID7021495
    • Carboxymethyl bromide
    • BP-20544
    • Bromoacetate ion
    • Bromoacetic acid, solid [UN1938] [Corrosive]
    • DB02198
    • CAS-79-08-3
    • NCGC00091467-01
    • 2-Bromoacetyl Group
    • STR00860
    • 2-bromanylethanoic acid
    • Bromoacetic acid, analytical standard
    • Acetic acid, bromo-
    • Z104473018
    • CCRIS 7886
    • CH2BrCOOH
    • NCGC00258211-01
    • WLN: QV1E
    • UNII-2B3HS32431
    • AI3-15301
    • monobromacetic acid
    • Kyselina bromoctova
    • FT-0648951
    • 4-02-00-00526 (Beilstein Handbook Reference)
    • Bromoacetic acid, solid [UN1938] [Corrosive]
    • EINECS 201-175-8
    • BXA
    • bromo acetic acid
    • MFCD00002678
    • Monobromessigsaeure
    • EN300-19170
    • UN3425
    • To NTU
    • InChI=1/C2H3BrO2/c3-1-2(4)5/h1H2,(H,4,5
    • J-519938
    • NSC-141
    • A839576
    • 79-08-3
    • .alpha.-Bromoethanoic acid
    • NSC 141
    • BRN 0506167
    • FT-0770735
    • Monobromessigsaeure [German]
    • F2191-0223
    • EPA Pesticide Chemical Code 008702
    • BROMOACETIC ACID, 2-
    • NA1938
    • Tox21_200657
    • Bromoacetic acid, reagent grade, 97%
    • 2-Bromoaceticacid
    • NS00010208
    • 2-Bromoacetic acid (ACI)
    • Acetic acid, bromo- (8CI, 9CI)
    • 1ST70014-1000Q
    • G77237
    • Bromoacetic acid Solution in MTBE, 1000ug/mL
    • to ntu
    • MDL： MFCD00002678
    • Inchi： 1S/C2H3BrO2/c3-1-2(4)5/h1H2,(H,4,5)
    • InChI Key： KDPAWGWELVVRCH-UHFFFAOYSA-N
    • SMILES： O=C(CBr)O
    • BRN： 506167

Computed Properties

  • Exact Mass: 137.93200
  • Monoisotopic Mass: 137.931642
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 5
  • Rotatable Bond Count: 1
  • Complexity: 42.9
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 0.4
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • Color/Form: Colorless crystal, easy to deliquescence. [1]
  • Density: 1.3429?g/mL
  • Melting Point: 46.0 to 50.0 deg-C
  • Boiling Point: 208?°C(lit.)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: n/D 1.4295
  • Solubility: chloroform: soluble10%, clear, colorless
  • Water Partition Coefficient: miscible
  • PSA: 37.30000
  • LogP: 0.46590
  • Solubility: It is easily soluble in water, ethanol, ether, acetone and benzene. [7]
  • Merck: 1400
  • Sensitiveness: Light Sensitive & Hygroscopic
  • pka: 2.69(at 25℃)
  • Color/Form: 1?M in dichloromethane

to ntu Security Information

to ntu Customs Data

  • HS CODE：2915900090
  • Customs Data：

    China Customs Code:

    2915900090

    Overview:

    2915900090. Other saturated acyclic monocarboxylic acids and their anhydrides(Acyl halide\Peroxygenation)Chemicals\Peroxy acid and its halogenation\nitrification\sulfonation\Nitrosative derivative. VAT:17.0%. Tax refund rate:9.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

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to ntu Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Diisopropylethylamine ,  Polyethylene glycol Solvents: Dichloromethane ;  cooled
1.2 Solvents: Dichloromethane ;  rt; 24 h, rt
Reference
Synthesis of 1-phenyl-3-butyl-2-thiohydantoin on soluble polymer support
Zhang, Gang-shen; Chen, Zu-xing; Yang, Gui-chun, Hubei Daxue Xuebao, 2005, 27(3), 257-258

Production Method 2

Reaction Conditions
1.1 Reagents: Phthalic acid ;  45 min
Reference
An efficient method for the synthesis of aliphatic acids using microwaves
Bratulescu, George, Revue Roumaine de Chimie, 2005, 50(3), 161-163

Production Method 3

Reaction Conditions
1.1 Reagents: Potassium peroxymonosulfate sulfate (2KHSO5.KHSO4.K2SO4) Catalysts: Hexadecyltrimethylammonium bromide ,  2-Iodobenzenesulfonic acid Solvents: Water ;  24 h, 100 °C
Reference
2-Iodoxybenzenesulfonic acid-catalyzed oxidation of primary and secondary alcohols with oxone in cetyltrimethylammonium bromide micelles at room temperature
Liu, Yangyang; Wang, Boliang, Journal of Chemical Research, 2014, 38(7), 427-431

Production Method 4

Reaction Conditions
1.1 Reagents: Hydrogen bromide Solvents: Water
Reference
Aliphatic bromides
, United States, , ,

Production Method 5

Reaction Conditions
1.1 Reagents: Chloro(1-methylethyl)magnesium Solvents: Tetrahydrofuran ;  -78 °C; 1 min, -78 °C
1.2 Solvents: Tetrahydrofuran ;  3 h, -78 °C
1.3 Reagents: Sodium bicarbonate Solvents: Water
1.4 Reagents: Hydrochloric acid Solvents: Water ;  acidified
Reference
A Straightforward Homologation of Carbon Dioxide with Magnesium Carbenoids en Route to α-Halocarboxylic Acids
Monticelli, Serena; Urban, Ernst; Langer, Thierry; Holzer, Wolfgang; Pace, Vittorio, Advanced Synthesis & Catalysis, 2019, 361(5), 1001-1006

Production Method 6

Reaction Conditions
1.1 Reagents: Bromine ,  Phosphorus tribromide ;  75 min, reflux
1.2 Solvents: Ethanol ;  30 min, reflux
Reference
Phosphorus(V) bromide
Mundy, Bradford P.; Stewart, Catherine A., e-EROS Encyclopedia of Reagents for Organic Synthesis, 2008, 1, 1-2

Production Method 7

Reaction Conditions
1.1 Reagents: Phosphorus tribromide
1.2 Reagents: Bromine
1.3 Solvents: Water
1.4 Reagents: Thiosulfuric acid (H2S35SO3), sodium salt (1:2) Solvents: Diethyl ether
Reference
Specific isotope enrichment of methyl methacrylate
Werkhoven, Thekla M.; Van Nispen, Reinier; Lugtenburg, Johan, European Journal of Organic Chemistry, 1999, (11), 2909-2914

Production Method 8

Reaction Conditions
1.1 Reagents: Diisopropylethylamine Solvents: Dichloromethane ;  cooled; overnight, rt; cooled
Reference
Synthesis of 1-benzyl-3-phenyl-2-thiohydantoin on soluble polymer support
Zhang, Gang-shen; Chen, Zu-xing; Yang, Gui-chun, Hubei Daxue Xuebao, 2004, 26(4), 327-329

Production Method 9

Reaction Conditions
1.1 Reagents: Diisopropylethylamine ,  Polyethylene glycol Solvents: Dichloromethane ;  0 °C; overnight, 0 °C
Reference
Microwave-assisted PEG-supported condensation of phenylsulfones and aldehydes
Yang, Gui-chun; Xie, Cheng; Lu, Cui-fen; Chen, Zu-xing, Hubei Daxue Xuebao, 2004, 26(1), 44-47

Production Method 10

Reaction Conditions
1.1 Reagents: Acetic anhydride ,  Pyridine ;  rt → reflux
1.2 Reagents: Bromine ;  reflux; cooled
1.3 Reagents: Water
Reference
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Wei, Guobing; Liao, Fusheng; Jiang, Guofang, Guangzhou Huagong, 2012, 40(11), 84-86

Production Method 11

Reaction Conditions
1.1 Solvents: Toluene ;  48 h, 110 °C
Reference
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Dai, Zhifeng; Bao, Yuanfei; Yuan, Jindong; Yao, Jinzhong; Xiong, Yubing, Chemical Communications (Cambridge, 2021, 57(76), 9732-9735

Production Method 12

Reaction Conditions
1.1 Reagents: N-Bromosuccinimide Catalysts: Sulfuric acid Solvents: Trifluoroacetic acid
Reference
A simple and efficient method of preparing α-bromo carboxylic acids
Zhang, Lian Hao; Duan, Jianxin; Xu, Yuelian; Dolbier, William R. Jr., Tetrahedron Letters, 1998, 39(52), 9621-9622

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Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:79-08-3)Bromoacetic acid
Order Number:sfd17035
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:37
Price ($):discuss personally
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:79-08-3)to ntu
Order Number:A1238613
Stock Status:in Stock
Quantity:5kg
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 18:56
Price ($):200
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:79-08-3)Bromoacetic acid
Order Number:LE15452;LE25516366
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:12
Price ($):discuss personally

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Suzhou Senfeida Chemical Co., Ltd
(CAS:79-08-3)Bromoacetic acid
sfd17035
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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Amadis Chemical Company Limited
(CAS:79-08-3)to ntu
A1238613
Purity:99%
Quantity:5kg
Price ($):200
Email