Home Halogens 1-[(3-chlorophenyl)methyl]cyclopentane-1-carboxylic acid

1-[(3-chlorophenyl)methyl]cyclopentane-1-carboxylic acid

CAS No.:
1226034-44-1
Catalog Number:
AG01AKZD
Molecular Formula:
C13H15ClO2
Molecular Weight:
238.7100
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Product Description
Catalog Number:
AG01AKZD
Chemical Name:
1-[(3-chlorophenyl)methyl]cyclopentane-1-carboxylic acid
CAS Number:
1226034-44-1
Molecular Formula:
C13H15ClO2
Molecular Weight:
238.7100
MDL Number:
MFCD16320492
IUPAC Name:
1-[(3-chlorophenyl)methyl]cyclopentane-1-carboxylic acid
InChI:
InChI=1S/C13H15ClO2/c14-11-5-3-4-10(8-11)9-13(12(15)16)6-1-2-7-13/h3-5,8H,1-2,6-7,9H2,(H,15,16)
InChI Key:
CBHZQTFACJLHQR-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)CC1(CCCC1)C(=O)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.076g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.711g/mol
Monoisotopic Mass:
238.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties