Home Carboxys 2-[4-(propan-2-yl)phenyl]cyclopropane-1-carboxylic acid

2-[4-(propan-2-yl)phenyl]cyclopropane-1-carboxylic acid

CAS No.:
1048919-66-9
Catalog Number:
AG01AKAJ
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
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Product Description
Catalog Number:
AG01AKAJ
Chemical Name:
2-[4-(propan-2-yl)phenyl]cyclopropane-1-carboxylic acid
CAS Number:
1048919-66-9
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
IUPAC Name:
2-(4-propan-2-ylphenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C13H16O2/c1-8(2)9-3-5-10(6-4-9)11-7-12(11)13(14)15/h3-6,8,11-12H,7H2,1-2H3,(H,14,15)
InChI Key:
NOGUBTGKXFAAGO-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C1CC1C(=O)O)C
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.269g/mol
Monoisotopic Mass:
204.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties