Indapamide Impurity D

CAT: 1299-RM-I041604-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-I041604-04Size:100 mg

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CAS Number

2494-79-3

Synonyms

4-chloro-3- (chlorosulfonyl) benzoic acid

Molecular Formula

C7H4Cl2O4S

Molecular Weight

255.08

Target Alternative Name

Indapamide

Product Name Synonym

4-chloro-3- (chlorosulfonyl) benzoic acid

Chemical Information

4-Chloro-3-(chlorosulphonyl)benzoic acid

CAS Number	2494-79-3
PubChem CID	75613
IUPAC Name	4-chloro-3-chlorosulfonylbenzoic acid
Molecular Formula	C7H4Cl2O4S
Molecular Weight	255.07
XLogP	2.1
Topological Polar Surface Area	79.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	321

SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)Cl)Cl

InChI

InChI=1S/C7H4Cl2O4S/c8-5-2-1-4(7(10)11)3-6(5)14(9,12)13/h1-3H,(H,10,11)

InChIKey

LYBQQYNSZYSUMT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2494-79-3

CID: 75613

Formula: C7H4Cl2O4S

MW: 255.07

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	255.07
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	253.9207352
Monoisotopic Mass	253.9207352
Topological Polar Surface Area	79.8 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	321
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes