2-Chloro-5-hydroxybenzoic acid

CAT: 0024-sc-274559Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-274559Size:250 mg

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CAS Number

56961-30-9

Chemical Information

2-Chloro-5-hydroxybenzoic acid

CAS Number	56961-30-9
PubChem CID	458210
IUPAC Name	2-chloro-5-hydroxybenzoic acid
Molecular Formula	C7H5ClO3
Molecular Weight	172.56
XLogP	1.8
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	160

SMILES

C1=CC(=C(C=C1O)C(=O)O)Cl

InChI

InChI=1S/C7H5ClO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,(H,10,11)

InChIKey

UTVCLUZQPSRKMY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 56961-30-9

CID: 458210

Formula: C7H5ClO3

MW: 172.56

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	172.56
XLogP3	1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	171.9927217
Monoisotopic Mass	171.9927217
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160
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

Catalog	Name
sc-276161	3-Chloro-5-hydroxybenzoic acid
sc-480783	2-Amino-4-chloro-5-hydroxybenzoic acid
sc-274518	2-Chloro-4-hydroxybenzoic acid
sc-346678	3-chloro-5-ethoxy-4-hydroxybenzoic acid
sc-346678A	3-chloro-5-ethoxy-4-hydroxybenzoic acid
sc-350204	5- (aminosulfonyl) -2-hydroxybenzoic acid
sc-274841	2-Fluoro-5-hydroxybenzoic acid
sc-471459	2-Hexanamido-5-Hydroxybenzoic Acid
sc-350204A	5- (aminosulfonyl) -2-hydroxybenzoic acid
sc-277235	4-Chloro-3-hydroxybenzoic acid

Catalog	Name
230165-01	2-Chloro-5-hydroxybenzoic acid
RG-E141485-01	5-Chloro-2-hydroxybenzoic acid
HY-W016866R-01	5-Chloro-2-hydroxybenzoic acid (Standard)
DNA02830-01	5- (2-Chloro-5-nitrobenzenesulfonamido) -2-hydroxybenzoic acid
M20816-01	3-chloro-5-hydroxybenzoic Acid
FC67861-01	2-Chloro-5-hydroxybenzoic acid ethyl ester