Cas no 80866-76-8 (3-Methyl-2-nitrobenzyl Alcohol)

3-Methyl-2-nitrobenzyl Alcohol is a versatile organic compound characterized by its unique substitution pattern. It exhibits excellent solubility in organic solvents, making it suitable for various chemical syntheses. Its nitro group provides a reactive site for nucleophilic substitution reactions, while the 3-methyl group enhances its stability. This compound is highly valued for its potential in pharmaceuticals, agrochemicals, and fine chemicals due to its ability to participate in multiple reaction pathways.
3-Methyl-2-nitrobenzyl Alcohol structure
80866-76-8 structure
Product Name:3-Methyl-2-nitrobenzyl Alcohol
CAS No:80866-76-8
MF:C8H9NO3
MW:167.161962270737
MDL:MFCD00007182
CID:728344
PubChem ID:24851312
Update Time:2025-10-31

3-Methyl-2-nitrobenzyl Alcohol Chemical and Physical Properties

Names and Identifiers

    • (3-Methyl-2-nitrophenyl)methanol
    • 2-Nitro-3-methylbenzenemethanol
    • 3-Methyl-2-nitrobenzyl alcohol
    • Benzenemethanol,3-methyl-2-nitro-
    • 3-Methyl-2-nitrobenzenemethanol (ACI)
    • 2-Methyl-6-hydroxymethyl-1-nitrobenzene
    • 3-Hydroxymethyl-2-nitrotoluene
    • DB-056468
    • EINECS 279-579-9
    • 80866-76-8
    • E78168
    • SCHEMBL67211
    • 3-Methyl-2-nitrobenzenemethanol
    • RD44XSC4ZG
    • MFCD00007182
    • Benzenemethanol, 3-methyl-2-nitro-
    • AKOS005255157
    • 3-Methyl-2-nitrobenzylalcohol
    • W-200505
    • NS00038090
    • InChI=1/C8H9NO3/c1-6-3-2-4-7(5-10)8(6)9(11)12/h2-4,10H,5H2,1H
    • PS-10582
    • CS-0204692
    • GEO-01888
    • (3-Methyl-2-nitrophenyl)methanol #
    • 3-Methyl-2-nitrobenzyl alcohol, 98%
    • DTXSID30230757
    • 3-Methyl-2-nitrobenzyl Alcohol
    • MDL： MFCD00007182
    • Inchi： 1S/C8H9NO3/c1-6-3-2-4-7(5-10)8(6)9(11)12/h2-4,10H,5H2,1H3
    • InChI Key： NELPTBUSFQMYOB-UHFFFAOYSA-N
    • SMILES： [O-][N+](C1C(CO)=CC=CC=1C)=O

Computed Properties

  • Exact Mass: 167.05800
  • Monoisotopic Mass: 167.058243
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 166
  • 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: 66
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing

Experimental Properties

  • Color/Form: Not available
  • Density: 1.2917 (rough estimate)
  • Melting Point: 48-50?°C (lit.)
  • Boiling Point: 295.73°C (rough estimate)
  • Flash Point: Degrees Fahrenheit:235.4°F
    Degrees Celsius:113°C
  • Refractive Index: 1.5570 (estimate)
  • PSA: 66.05000
  • LogP: 1.91870
  • Solubility: Not available
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

3-Methyl-2-nitrobenzyl Alcohol Security Information

  • Signal Word：warning
  • Hazard Statement： H303+H313+H333
  • Warning Statement： P264+P280+P305+P351+P338+P337+P313
  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Hazard Category Code： 36/37/38
  • Safety Instruction： S24/25
  • Risk Phrases：R36/37/38
  • Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

3-Methyl-2-nitrobenzyl Alcohol Customs Data

  • HS CODE：2906299090
  • Customs Data：

    China Customs Code:

    2906299090

    Overview:

    2906299090 Other aromatic alcohols. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2906299090 other aromatic alcohols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

3-Methyl-2-nitrobenzyl Alcohol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A014001467-250mg
3-Methyl-2-nitrobenzyl alcohol
 80866-76-8 97%
250mg
 $480.00 2023-09-01
Alichem
A014001467-500mg
3-Methyl-2-nitrobenzyl alcohol
 80866-76-8 97%
500mg
 $815.00 2023-09-01
Alichem
A014001467-1g
3-Methyl-2-nitrobenzyl alcohol
 80866-76-8 97%
1g
 $1445.30 2023-09-01
TRC
B495393-50mg
3-Methyl-2-nitrobenzyl Alcohol
 80866-76-8
50mg
 $ 50.00 2022-06-07
TRC
B495393-100mg
3-Methyl-2-nitrobenzyl Alcohol
 80866-76-8
100mg
 $ 65.00 2022-06-07
TRC
B495393-500mg
3-Methyl-2-nitrobenzyl Alcohol
 80866-76-8
500mg
 $ 135.00 2022-06-07
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
SA02683-25g
(3-Methyl-2-nitrophenyl)methanol
 80866-76-8 98%
25g
 ￥1095.0 2024-07-19
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
SA02683-5g
(3-Methyl-2-nitrophenyl)methanol
 80866-76-8 98%
5g
 ￥313.0 2024-07-19
XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd.
188263-5G
3-Methyl-2-nitrobenzyl Alcohol
 80866-76-8
5g
 ￥1044.24 2023-12-10
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
M915781-1g
(3-Methyl-2-nitrophenyl)methanol
 80866-76-8 98%
1g
 ￥349.20 2022-01-11

3-Methyl-2-nitrobenzyl Alcohol Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: (T-4)-Trihydro(tetrahydrofuran)boron Solvents: Tetrahydrofuran ;  reflux
Reference
Pendant Alkoxy Groups on N-Aryl Substitutions Drive the Efficiency of Imidazolylidene Catalysts for Homoenolate Annulation from Enal and Aldehyde
Kyan, Ryuji; et al, Angewandte Chemie, 2020, 59(43), 19031-19036

Production Method 2

Reaction Conditions
1.1 Reagents: Sodium borohydride Catalysts: Copper(II) phthalocyaninetetrasulfonate Solvents: Tetrahydrofuran ;  0 - 5 °C; 30 min, 0 - 5 °C; 5 °C → 30 °C; 1 - 2 h, 25 - 30 °C
1.2 Reagents: Water ;  0 °C
1.3 Reagents: Sodium bicarbonate Solvents: Water ;  pH 7 - 8
Reference
Chemo-selective CuPcS catalyzed reduction and esterification of carboxylic acid analogs
Patel, Siddharth S.; et al, New Journal of Chemistry, 2023, 47(35), 16359-16367

Production Method 3

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Dimethylformamide ,  Tetrahydrofuran ;  0 °C; 3 h, rt
1.2 Reagents: Hydrochloric acid Solvents: Water ;  rt
Reference
Enabling CO Insertion into o-Nitrostyrenes beyond Reduction for Selective Access to Indolin-2-one and Dihydroquinolin-2-one Derivatives
Yang, Li; et al, ACS Catalysis, 2018, 8(11), 10340-10348

Production Method 4

Reaction Conditions
1.1 Reagents: Borane Solvents: Tetrahydrofuran ;  1 h, cooled; 48 h, rt
Reference
A programmable polymer library that enables the construction of stimuli-responsive nanocarriers containing logic gates
Zhang, Penghui ; et al, Nature Chemistry, 2020, 12(4), 381-390

Production Method 5

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Methanol ;  4 h, 0 °C
1.2 Reagents: Water
Reference
Enantioenriched 1,4-Benzoxazepines via Chiral Bronsted Acid-Catalyzed Enantioselective Desymmetrization of 3-Substituted Oxetanes
Nigrini, Martin; et al, Journal of Organic Chemistry, 2023, 88(24), 17024-17036

Production Method 6

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Dimethylformamide ,  Tetrahydrofuran ,  Nitrogen
Reference
Preparation and reaction of isomeric formyl-2,1-benzisoxazoles
Phillips, Brian T.; et al, Journal of Heterocyclic Chemistry, 1986, 23(3), 897-9

3-Methyl-2-nitrobenzyl Alcohol Raw materials

3-Methyl-2-nitrobenzyl Alcohol Preparation Products

3-Methyl-2-nitrobenzyl Alcohol Related Literature

Related Categories

80866-76-8 (3-Methyl-2-nitrobenzyl Alcohol) Related Products

Recommended suppliers
Shanghai Joy Biotech Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Joy Biotech Ltd
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Yunnanjiuzhen
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Yunnanjiuzhen
Changzhou Guanjia Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Changzhou Guanjia Chemical Co., Ltd