5-[(2-Carboxyphenyl)sulfamoyl]-2-chlorobenzoic acid

CAS

91-36-1

Catalog Number

ACM91361

Category

Other Products

Molecular Weight

355.75 g/mol

Molecular Formula

C₁₄H₁₀ClNO₆S

MSDS COA Spec Sheet

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Specification

Synonyms

MolPort-002-363-457, CID66673, EINECS 202-064-7, 5-(((2-Carboxyphenyl)amino)sulphonyl)-2-chlorobenzoic acid, Benzoic acid, 5-(((2-carboxyphenyl)amino)sulfonyl)-2-chloro-, 91-36-1

IUPAC Name

5-[(2-carboxyphenyl)sulfamoyl]-2-chlorobenzoic acid

Canonical SMILES

C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O

InChI Key

XYUBQRPKIVSWKI-UHFFFAOYSA-N

Boiling Point

603.1ºC at 760 mmHg

Flash Point

318.5ºC

Density

1.65g/cm³

EC Number

202-064-7

Exact Mass

354.99200

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound?

The molecular formula of the compound is C14H10ClNO6S.

What is the molecular weight of the compound?

The molecular weight of the compound is 355.8 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 5-[(2-carboxyphenyl)sulfamoyl]-2-chlorobenzoic acid.

What is the InChI code of the compound?

The InChI code of the compound is InChI=1S/C14H10ClNO6S/c15-11-6-5-8(7-10(11)14(19)20)23(21,22)16-12-4-2-1-3-9(12)13(17)18/h1-7,16H,(H,17,18)(H,19,20).

What is the InChIKey of the compound?

The InChIKey of the compound is XYUBQRPKIVSWKI-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O.

What is the CAS number of the compound?

The CAS number of the compound is 91-36-1.

What is the European Community (EC) number of the compound?

The European Community (EC) number of the compound is 202-064-7.

What is the UNII of the compound?

The UNII of the compound is GG4YX75MUN.

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