Home Carboxys 2-methyl-3-phenylcyclopropane-1-carboxylic acid

2-methyl-3-phenylcyclopropane-1-carboxylic acid

CAS No.:
24581-87-1
Catalog Number:
AG01BHL7
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
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Product Description
Catalog Number:
AG01BHL7
Chemical Name:
2-methyl-3-phenylcyclopropane-1-carboxylic acid
CAS Number:
24581-87-1
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD20643770
IUPAC Name:
2-methyl-3-phenylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C11H12O2/c1-7-9(10(7)11(12)13)8-5-3-2-4-6-8/h2-7,9-10H,1H3,(H,12,13)
InChI Key:
MRSGPOUTCALJOZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1C(C1C)c1ccccc1
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties