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2-Methyl-3-nitrophenol

2-Methyl-3-nitrophenol structure

CAS No:
5460-31-1
Formula:
C7H7NO3
Chemical Name:
2-Methyl-3-nitrophenol
Synonyms:
Phenol,2-methyl-3-nitro-;o-Cresol,3-nitro-;2-Methyl-3-nitrophenol;6-Hydroxy-2-nitrotoluene;3-Nitro-2-methylphenol;3-Nitro-o-cresol;NSC 25009;2-Hydroxy-6-nitrotoluene
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

Yellow to brown crystalline powder

2-Methyl-3-nitrophenol Basic Attributes

Molecular Weight：

153.14

Exact Mass：

153.14

BRN：

1946057

EC Number：

226-739-0

UNII：

XL5HG597X2

NSC Number：

25009

DSSTox ID：

DTXSID00203034

HScode：

29089000

Characteristics

PSA：

XLogP3：

2.1

Appearance：

Dark brown crystalline powder

Density：

1.3±0.1 g/cm3

Melting Point：

69 °C

Boiling Point：

147.0-152.0°C

Flash Point：

121.8±12.5 °C

Refractive Index：

1.597

Water Solubility：

95% ethanol: soluble 50mg/mL

Storage Conditions：

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2446 6.1/PG 3

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37-36/37/39-36-24/25

Marks：

Xn,Xi

Hazard note：

Harmful

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：

|Danger|H302 (93.48%): 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, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 46 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Methyl-3-nitrophenol Use and Manufacturing

Used in organic synthesis, medicine and dye synthesis

Computed Properties

Molecular Weight:153.14
XLogP3:2.1
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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