2- (4-Hydroxyphenyl) propionic acid

CAT: 0024-sc-273883ASize: 50 gDry Ice: NoHazardous: No

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CAT#:0024-sc-273883ASize:50 g

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CAS Number

938-96-5

Chemical Information

2-(4-Hydroxyphenyl)propionic acid

4-Hydroxyhydratropate is a monocarboxylic acid.

CAS Number	938-96-5
PubChem CID	102526
IUPAC Name	2-(4-hydroxyphenyl)propanoic acid
Molecular Formula	C9H10O3
Molecular Weight	166.17
XLogP	1.6
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	159

SMILES

CC(C1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C9H10O3/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6,10H,1H3,(H,11,12)

InChIKey

ZHMMPVANGNPCBW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 938-96-5

CID: 102526

Formula: C9H10O3

MW: 166.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.17
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	166.062994177
Monoisotopic Mass	166.062994177
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	159
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-209464D	3- (4-Hydroxyphenyl) propionic Acid
sc-209464A	3- (4-Hydroxyphenyl) propionic Acid
sc-209464B	3- (4-Hydroxyphenyl) propionic Acid
sc-209464C	3- (4-Hydroxyphenyl) propionic Acid
sc-209464	3- (4-Hydroxyphenyl) propionic Acid
sc-238454	3- (2-Hydroxyphenyl) propionic acid
sc-275695	3- (3-Hydroxyphenyl) propionic acid
sc-296221	(R) -3-Amino-3- (4-hydroxyphenyl) propionic acid
sc-296343A	(S) -3-Amino-3- (4-hydroxyphenyl) propionic acid
sc-214111A	3- (4-Hydroxyphenyl) propionic acid N-hydroxysuccinimide ester

Catalog	Name
FH24472	3- (4-Hydroxyphenyl) propionic acid
TRC-H950820-50G	3-(4-Hydroxyphenyl)propionic Acid
HY-W067425-01	2- (4-Hydroxyphenyl) propionic acid
280002-01	3- (4-Hydroxyphenyl) propionic acid hydrazide
231409-01	3- (4'-Hydroxyphenyl) propionic acid 99+%
TRC-H950821-25MG	3-(4-Hydroxyphenyl)propionic Acid-d4
TMIH-0040-01	3- (4-Hydroxyphenyl) propionic acid-d4
279928-01	3- (4'-Hydroxyphenyl) propionic acid-OSu
TRC-H949495-10G	3-(4-Hydroxyphenyl)propionic Acid Methyl Ester
BII105	3- (4-Hydroxyphenyl) propionic acid hydrazide hydrochloride