Home Carboxys 1-(2-phenylethyl)cyclopropane-1-carboxylic acid

1-(2-phenylethyl)cyclopropane-1-carboxylic acid

CAS No.:
3454-81-7
Catalog Number:
AG01EK8L
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG01EK8L
Chemical Name:
1-(2-phenylethyl)cyclopropane-1-carboxylic acid
CAS Number:
3454-81-7
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD20643342
IUPAC Name:
1-(2-phenylethyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C12H14O2/c13-11(14)12(8-9-12)7-6-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,14)
InChI Key:
JXAWJBQQLYHPDJ-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCc2ccccc2)CC1
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties