4-Sulfamoylbenzoic acid | CAS No. 138-41-0

4-Sulfamoylbenzoic acid

Basic Information

CAS Number

138-41-0

Molecular Formula

C7H7NO4S

Molecular Weight

201.2 g/mol

AD

Basic Physical Properties

Melting Point

285-295 °C

Boiling Point

449°C at 760 mmHg

Water Solubility

453 mg/L (25 ºC)

Flash Point

225.4°C

Solubility

0.5g/l

Refractive Index

1.6100 (estimate)

C1=CC(=CC=C1C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C7H7NO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)

InChIKey

UCAGLBKTLXCODC-UHFFFAOYSA-N

LogP

0.03219999999999995

pKa

3.50(at 25℃)

Topological Polar Surface Area

97.46000000000001 Ų

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

284

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Toxicity

LD50 i.p. in rats: 350 ± 22 mg/kg (Appenroth, Brunlich)

Synonyms & References

English

  • JMC523116 Compound 22
  • MLS000069605
  • SR-01000000114-2
  • Oprea1_448551
  • BDBM4703
  • 4-Sulfamoylbenzoic acid, 97%
  • SBI-0054135.P002
  • p-Sulfamylbenzoic acid
  • P-SULFAMOYL-BENZOIC ACID
  • AS-14571
  • 4-Sulfamoylbenzoic acid
  • Z53021532
  • NCGC00013287-06
  • HY-B0989
  • 4-carboxy-benzenesulfonamide
  • Carzenide
  • 4-carboxybenzenesulfonamide 1
  • F0347-1766
  • CHEMBL414
  • 4-sulamoylbenzoic acid
  • AKOS000144547
  • Benzoic acid 4-sulfamide
  • 4-Sulfamoyl-benzoic acid
  • Benzoic acid, 4-(aminosulfonyl)-
  • CHEBI:177418
  • CARZENIDE [MART.]
  • p-Aminosulfonyl-benzoic Acid
  • s4556
  • SMR000059013
  • SCHEMBL312419
  • UNII-30Z5HQB5A4

MDL Number

MFCD00007938

Customs Code

2935009090

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