Home Carboxys 1-(3-methoxy-4-methylphenyl)cyclopentane-1-carboxylic acid

1-(3-methoxy-4-methylphenyl)cyclopentane-1-carboxylic acid

CAS No.:
923172-11-6
Catalog Number:
AG00GUBZ
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
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Product Description
Catalog Number:
AG00GUBZ
Chemical Name:
1-(3-methoxy-4-methylphenyl)cyclopentane-1-carboxylic acid
CAS Number:
923172-11-6
Molecular Formula:
C14H18O3
Molecular Weight:
234.2909
MDL Number:
MFCD08444757
IUPAC Name:
1-(3-methoxy-4-methylphenyl)cyclopentane-1-carboxylic acid
InChI:
InChI=1S/C14H18O3/c1-10-5-6-11(9-12(10)17-2)14(13(15)16)7-3-4-8-14/h5-6,9H,3-4,7-8H2,1-2H3,(H,15,16)
InChI Key:
BJEXAQNLMVNICS-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1C)C1(CCCC1)C(=O)O
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.126g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.295g/mol
Monoisotopic Mass:
234.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties