Cas no 875664-25-8 (4-Bromo-2-phenoxybenzonitrile)

4-Bromo-2-phenoxybenzonitrile structure

Product Name:4-Bromo-2-phenoxybenzonitrile

CAS No:875664-25-8

MF:C₁₃H₈BrNO

MW:274.112722396851

MDL:MFCD13193389

CID:1036593

PubChem ID:57436665

Update Time:2024-10-26

4-Bromo-2-phenoxybenzonitrile Chemical and Physical Properties

Names and Identifiers

- 4-Bromo-2-phenoxybenzonitrile
- 4-bromo-2-phenoxy-benzonitrile
- WFMNRTXOZNBDSV-UHFFFAOYSA-N
- BC4716123
- AX8248305
- ST2418180
- Z5239
- 4-Bromo-2-phenoxybenzonitrile (ACI)
- SCHEMBL490118
- DB-340132
- CS-0019342
- MFCD13193389
- AKOS016000664
- 875664-25-8
- DS-1606
- DTXSID40726414
- MDL： MFCD13193389
- Inchi： 1S/C13H8BrNO/c14-11-7-6-10(9-15)13(8-11)16-12-4-2-1-3-5-12/h1-8H
- InChI Key： WFMNRTXOZNBDSV-UHFFFAOYSA-N
- SMILES： N#CC1C(OC2C=CC=CC=2)=CC(Br)=CC=1

Computed Properties

Exact Mass: 272.97900
Monoisotopic Mass: 272.97893g/mol
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Heavy Atom Count: 16
Rotatable Bond Count: 2
Complexity: 266
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
Topological Polar Surface Area: 33
XLogP3: 3.9

Experimental Properties

PSA: 33.02000
LogP: 4.11308

4-Bromo-2-phenoxybenzonitrile Security Information

Signal Word：Warning
Hazard Statement： H302
Warning Statement： P280-P305+P351+P338
Storage Condition：Sealed in dry,Room Temperature

4-Bromo-2-phenoxybenzonitrile Customs Data

HS CODE：2926909090
Customs Data：

China Customs Code:
2926909090

Overview:

2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

Declaration elements:

Product Name, component content, use to

Summary:

HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

4-Bromo-2-phenoxybenzonitrile Pricemore >>

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Chemenu	CM153952-1g	4-Bromo-2-phenoxybenzonitrile	875664-25-8	95+%	1g	$183	2021-06-17
Chemenu	CM153952-5g	4-Bromo-2-phenoxybenzonitrile	875664-25-8	95+%	5g	$468	2021-06-17
SHANG HAI XIAN DING Biotechnology Co., Ltd.	B-MO743-50mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8	98%	50mg	195.0CNY	2021-07-10
SHANG HAI XIAN DING Biotechnology Co., Ltd.	B-MO743-1g	4-Bromo-2-phenoxybenzonitrile	875664-25-8	98%	1g	1373.0CNY	2021-07-10
SHANG HAI XIAN DING Biotechnology Co., Ltd.	B-MO743-250mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8	98%	250mg	742CNY	2021-05-08
TRC	B113420-250mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8		250mg	$ 265.00	2022-06-07
TRC	B113420-500mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8		500mg	$ 440.00	2022-06-07
TRC	B113420-1000mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8		1g	$ 700.00	2022-06-07
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.	B899265-5g	4-Bromo-2-phenoxybenzonitrile	875664-25-8	98%	5g	￥4,121.10	2022-09-02
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.	B899265-250mg	4-Bromo-2-phenoxybenzonitrile	875664-25-8	98%	250mg	￥586.80	2022-09-02

4-Bromo-2-phenoxybenzonitrile Production Method

Production Method 1

105942-08-3

875664-25-8

Reaction Conditions

1.1 Reagents: Potassium carbonate Solvents: Dimethylformamide , Toluene ; 4 h, reflux; reflux → rt
1.2 4 h, reflux

Reference

High-Contrast Polymorphic Luminogen Formed through Effect of Tiny Differences in Intermolecular Interactions on the Intramolecular Charge Transfer Process

Wang, Kang; et al, Advanced Optical Materials, 2020, 8(16),

Production Method 2

118-55-8

875664-25-8

Reaction Conditions

1.1 Reagents: Sodium hydroxide Solvents: Water ; 8 h, rt
1.2 Reagents: Hydrochloric acid Solvents: Water ; rt
2.1 Reagents: Potassium carbonate Solvents: Dimethylformamide ; 10 h, 100 °C

Reference

Efficient Aryl Migration from an Aryl Ether to a Carboxylic Acid Group To Form an Ester by Visible-Light Photoredox Catalysis

Wang, Shao-Feng; et al, Angewandte Chemie, 2017, 56(44), 13809-13813

Production Method 3

2243-42-7

875664-25-8

Reaction Conditions

1.1 Catalysts: Dipotassium phosphate , 2,9-Bis[2,6-bis(1-methylethyl)phenyl]anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoli… Solvents: Acetonitrile ; 32 h, rt
1.2 Reagents: Sodium hydroxide Solvents: Water ; 8 h, rt
1.3 Reagents: Hydrochloric acid Solvents: Water ; rt
2.1 Reagents: Potassium carbonate Solvents: Dimethylformamide ; 10 h, 100 °C

Reference

Efficient Aryl Migration from an Aryl Ether to a Carboxylic Acid Group To Form an Ester by Visible-Light Photoredox Catalysis

Wang, Shao-Feng; et al, Angewandte Chemie, 2017, 56(44), 13809-13813

Production Method 4

6476-32-0

875664-25-8

Reaction Conditions

1.1 Reagents: Sodium hydroxide Solvents: Ethanol , Water ; 16 h, reflux; reflux → rt
1.2 Reagents: Hydrochloric acid Solvents: Water ; acidified
2.1 Catalysts: Dipotassium phosphate , 2,9-Bis[2,6-bis(1-methylethyl)phenyl]anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoli… Solvents: Acetonitrile ; 32 h, rt
2.2 Reagents: Sodium hydroxide Solvents: Water ; 8 h, rt
2.3 Reagents: Hydrochloric acid Solvents: Water ; rt
3.1 Reagents: Potassium carbonate Solvents: Dimethylformamide ; 10 h, 100 °C

Reference

Efficient Aryl Migration from an Aryl Ether to a Carboxylic Acid Group To Form an Ester by Visible-Light Photoredox Catalysis

Wang, Shao-Feng; et al, Angewandte Chemie, 2017, 56(44), 13809-13813

4-Bromo-2-phenoxybenzonitrile Raw materials

4-Bromo-2-phenoxybenzonitrile Preparation Products

4-Bromo-2-phenoxybenzonitrile (875664-25-8)

4-Bromo-2-phenoxybenzonitrile Related Literature

1. Fe3O4 nanoclusters highly dispersed on a porous graphene support as an additive for improving the hydrogen storage properties of LiBH4?

Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
2. Examination of deposit in commercial diluted phosphoric acid

Analyst, 1880,5, 146-147
3. Evolution of calcium phosphate precipitation in hanging drop vapor diffusion by in situRaman microspectroscopy

Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
4. Esterase-responsive polymeric prodrug-based tumor targeting nanoparticles for improved anti-tumor performance against colon cancer?

Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
5. Fast-Track to Research Data Management in Experimental Material Science-Setting the Ground for Research Group Level Materials Digitalization.

LarsBanko,AlfredLudwig

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Cas no 875664-25-8 (4-Bromo-2-phenoxybenzonitrile)

4-Bromo-2-phenoxybenzonitrile Chemical and Physical Properties

Names and Identifiers

Computed Properties

Experimental Properties

4-Bromo-2-phenoxybenzonitrile Security Information

4-Bromo-2-phenoxybenzonitrile Customs Data

China Customs Code:

Overview:

Declaration elements:

Summary:

4-Bromo-2-phenoxybenzonitrile Pricemore >>

4-Bromo-2-phenoxybenzonitrile Production Method

Production Method 1

Production Method 2

Production Method 3

Production Method 4

4-Bromo-2-phenoxybenzonitrile Raw materials

4-Bromo-2-phenoxybenzonitrile Preparation Products

4-Bromo-2-phenoxybenzonitrile Related Literature

Related Categories

875664-25-8 (4-Bromo-2-phenoxybenzonitrile) Related Products