Benzoic acid,5-(aminosulfonyl)-2-chloro-

CAS
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CAS
97-04-1
Size
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Purity
96%
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Catalog Number

ACM97041

Product Name

Benzoic acid,5-(aminosulfonyl)-2-chloro-

Structure

Structure

CAS

97-04-1

Category

Heterocyclic Organic Compound

Synonyms

3-CARBOXY-4-CHLOROBENZENESULFONAMIDE;5-(AMINOSULFONYL)-2-CHLOROBENZOIC ACID;2-CHLORO-5-SULFAMOYLBENZOIC ACID;2-chloro-5-sulphamoylbenzoic acid;2-Chloro-5-sulfaminebenzoic;5-Sulfamoyl-2-chlorobenzoic acid;Benzoic acid, 5-(aminosulfonyl)-2-chloro-;Einecs 2

IUPAC Name

2-chloro-5-sulfamoylbenzoic acid

Molecular Weight

235.64

Molecular Formula

C₇H₆ClNO₄S

Canonical SMILES

C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)Cl

InChI Key

LWDSANAOYPHQAW-UHFFFAOYSA-N

Boiling Point

478.7ºC at 760mmHg

Melting Point

214-215ºC

Flash Point

243.3ºC

Density

1.649g/cm³

Appearance

Beige Solid

EC Number

202-554-0

Exact Mass

234.97100

H-Bond Acceptor

5

H-Bond Donor

2

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The molecular formula is C7H6ClNO4S.

What is the IUPAC Name of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The IUPAC Name is 2-chloro-5-sulfamoylbenzoic acid.

What is the InChI of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The InChI is InChI=1S/C7H6ClNO4S/c8-6-2-1-4(14(9,12)13)3-5(6)7(10)11/h1-3H,(H,10,11)(H2,9,12,13).

What is the InChIKey of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The InChIKey is LWDSANAOYPHQAW-UHFFFAOYSA-N.

What is the Canonical SMILES of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The Canonical SMILES is C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)Cl.

What is the molecular weight of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The molecular weight is 235.65 g/mol.

What is the CAS number of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The CAS number is 97-04-1.

What is the European Community (EC) number of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The European Community (EC) number is 202-554-0.

What is the UNII of Benzoic acid, 5-(aminosulfonyl)-2-chloro?

The UNII is Q3HMU86N2T.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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