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1-Methoxy-2-methyl-4-nitrobenzene

1-Methoxy-2-methyl-4-nitrobenzene structure

CAS No:
50741-92-9
Formula:
C8H9NO3
Chemical Name:
1-Methoxy-2-methyl-4-nitrobenzene
Synonyms:
Benzene,1-methoxy-2-methyl-4-nitro-;Anisole,2-methyl-4-nitro-;1-Methoxy-2-methyl-4-nitrobenzene;2-Methyl-4-nitroanisole;2-Methoxy-5-nitrotoluene;4-Methoxy-3-methylnitrobenzene;3-Methyl-4-methoxynitrobenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-Methoxy-2-methyl-4-nitrobenzene Basic Attributes

Molecular Weight：

167.16200

Exact Mass：

167.16

EC Number：

256-748-5

DSSTox ID：

DTXSID70198786

HScode：

2909309090

Characteristics

PSA：

55.05000

XLogP3：

2.43500

Appearance：

Off-white solid

Density：

1.18 g/cm3

Melting Point：

63 °C @ Solvent: Ligroine

Boiling Point：

283ºC at 760 mmHg

Flash Point：

136.7ºC

Safety Information

hazard class code：

R22

safety instructions：

S26; S36

Marks：

Xn; Xi

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:167.16
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:167.058243149
Monoisotopic Mass:167.058243149
Topological Polar Surface Area:55
Heavy Atom Count:12
Complexity:166
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-METHYL-4-NITROANISOLE 97

CAS No.: 50741-92-9

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Guide of 1-Methoxy-2-methyl-4-nitrobenzene

Basic Attributes
Characteristics
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Computed Properties
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