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(S) - (+) -2-phenylpropionic acid

CAT: 0013-GTR19250630-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19250630-01Size:200 mg
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Description
(S) - (+) -2-phenylpropionic acid
CAS Number
7782-24-3
Smiles
C[C@H] (C (O) =O) c1ccccc1
Molecular Formula
C9H10O2
Molecular Weight
150.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Phenylpropionic acid, (+)-

(S)-hydratropic acid is a hydratropic acid. It is an enantiomer of a (R)-hydratropic acid.

CAS Number7782-24-3
PubChem CID2724622
IUPAC Name(2S)-2-phenylpropanoic acid
Molecular FormulaC9H10O2
Molecular Weight150.17
XLogP1.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity136
SMILES
C[C@@H](C1=CC=CC=C1)C(=O)O
InChI
InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m0/s1
InChIKey
YPGCWEMNNLXISK-ZETCQYMHSA-N
Chemical Structure
2D Structure
2D structure of 2-Phenylpropionic acid, (+)-
CAS: 7782-24-3
CID: 2724622
Formula: C9H10O2
MW: 150.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.17
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass150.068079557
Monoisotopic Mass150.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity136
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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