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Home > Encyclopedia > 2-(4-methyl-3-nitrophenyl)acetic acid

2-(4-methyl-3-nitrophenyl)acetic acid

2-(4-methyl-3-nitrophenyl)acetic acid structure

2-(4-methyl-3-nitrophenyl)acetic acid 

structure
  • CAS No:

    54941-44-5

  • Formula:

    C9H9NO4

  • Chemical Name:

    2-(4-methyl-3-nitrophenyl)acetic acid

  • Synonyms:

    CL4118; 3-nitro p-tolylacetic acid; 3-nitro-4-methylphenylacetic acid; 4-methyl-3-nitrophenylacetic acid; 3-Nitro-4-methyl-phenylessigsaeure;

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

2-(4-methyl-3-nitrophenyl)acetic acid Basic Attributes

195.17200

195.05315777

DTXSID90592681

2916399090

Characteristics

83.12000

2.05350

1.346g/cm3

374.5ºC at 760 mmHg

166.5ºC

1.587

Safety Information

|Warning|H302 (100%): 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, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:195.17
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:195.05315777
Monoisotopic Mass:195.05315777
Topological Polar Surface Area:83.1
Heavy Atom Count:14
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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