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938-95-4

938-95-4 | 2-(4-Chlorophenyl)propanoic acid

CAS No: 938-95-4 Catalog No: AG003EVV MDL No:MFCD20638480

Product Description

Catalog Number:
AG003EVV
Chemical Name:
2-(4-Chlorophenyl)propanoic acid
CAS Number:
938-95-4
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD20638480
IUPAC Name:
2-(4-chlorophenyl)propanoic acid
InChI:
InChI=1S/C9H9ClO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)
InChI Key:
YOZILQVNIWNPFP-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)Cl)C(=O)O
EC Number:
213-351-1

Properties

Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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