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3-Methyl-2-nitrophenol

3-Methyl-2-nitrophenol structure

CAS No:
4920-77-8
Formula:
C7H7NO3
Chemical Name:
3-Methyl-2-nitrophenol
Synonyms:
Phenol,3-methyl-2-nitro-;m-Cresol,2-nitro-;3-Methyl-2-nitrophenol;3-Hydroxy-2-nitrotoluene;2-Nitro-3-methylphenol;2-Nitro-m-cresol;2-Hydroxy-6-methylnitrobenzene;NSC 41206;2-Nitro-3-hydroxytoluene;2-Methyl-6-hydroxynitrobenzene
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

Yellow Solid

3-Methyl-2-nitrophenol Basic Attributes

Molecular Weight：

153.14

Exact Mass：

153.14

EC Number：

225-546-9

UNII：

I4QBB2L3C0

NSC Number：

41206

DSSTox ID：

DTXSID90197716

HScode：

2908999090

Characteristics

PSA：

XLogP3：

2.3

Appearance：

yellow to orange-brown crystalline powder or low melting mass

Density：

1.3±0.1 g/cm3

Melting Point：

35-39 °C

Boiling Point：

106-108 °C

Flash Point：

225 °F

Refractive Index：

1.597

Water Solubility：

0.02 M

Storage Conditions：

0-10°C

Vapor Pressure：

0.04 mmHg

Henrys Law Constant：

3.06e-06 atm-m3/mole

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

UN 2446 6.1/PG 3

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37-37/39-36

Marks：

Xn,Xi

Hazard note：

Harmful/Irritant

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302 + H312 + H332-H315-H319-H335

GHS Classification：

|Warning|H302 (97.62%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3-methyl-2-nitrophenol

3-Methyl-2-nitrophenol Use and Manufacturing

A nitrophenol derivative as antitumor

Computed Properties

Molecular Weight:153.14
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:153.042593085
Monoisotopic Mass:153.042593085
Topological Polar Surface Area:66
Heavy Atom Count:11
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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