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Home > Encyclopedia > 2-Nitro-5-thiobenzoic acid

2-Nitro-5-thiobenzoic acid

2-Nitro-5-thiobenzoic acid structure

2-Nitro-5-thiobenzoic acid 

structure
  • CAS No:

    15139-21-6

  • Formula:

    C7H5NO4S

  • Chemical Name:

    2-Nitro-5-thiobenzoic acid

  • Synonyms:

    3-carboxyl-4-nitrobenzenethiol; 5-mercapto-2-nitrobenzoic acid; 5-Thiazolecarboxylicacid,2-nitro; 5-thio-2-nitrobenzoic acid; 3-mercapto-6-nitrobenzoic acid; 2-nitro-thiazole-5-carboxylic acid; 2-Nitro-5-thiazolcarbonsaeure;Expand

2-Nitro-5-thiobenzoic acid Basic Attributes

199.18400

198.99392881 g/mol

OWT399B07G

2930909090

Characteristics

121.92000

2.10490

1.575g/cm3

419.2ºC at 760mmHg

207.4ºC

1.682

8.87E-08mmHg at 25°C

Safety Information

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

2-nitro-5-mercaptobenzoic acid

Computed Properties

Molecular Weight:199.19
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:198.99392881
Monoisotopic Mass:198.99392881
Topological Polar Surface Area:84.1
Heavy Atom Count:13
Complexity:227
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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