Home Halogens 2-(3-chlorophenyl)pentanoic acid

2-(3-chlorophenyl)pentanoic acid

CAS No.:
1226181-74-3
Catalog Number:
AG01BV8R
Molecular Formula:
C11H13ClO2
Molecular Weight:
212.6727
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Product Description
Catalog Number:
AG01BV8R
Chemical Name:
2-(3-chlorophenyl)pentanoic acid
CAS Number:
1226181-74-3
Molecular Formula:
C11H13ClO2
Molecular Weight:
212.6727
MDL Number:
MFCD16308480
IUPAC Name:
2-(3-chlorophenyl)pentanoic acid
InChI:
InChI=1S/C11H13ClO2/c1-2-4-10(11(13)14)8-5-3-6-9(12)7-8/h3,5-7,10H,2,4H2,1H3,(H,13,14)
InChI Key:
RLXOUELFISPMSF-UHFFFAOYSA-N
SMILES:
CCCC(c1cccc(c1)Cl)C(=O)O
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.06g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.673g/mol
Monoisotopic Mass:
212.06g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties