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1-phenylcyclopropane-1-carboxylic acid

1-phenylcyclopropane-1-carboxylic acid

CAS: 6120-95-2

Formula: C10H10O2

SMILES: OC(=O)C1(CC1)C1=CC=CC=C1

IUPAC: 1-phenylcyclopropane-1-carboxylic acid

InChI: InChI=1S/C10H10O2/c11-9(12)10(6-7-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)

Composition: C (74.06%), H (6.22%), O (19.73%)

Molar Mass: 162.188

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 162.068079562
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IWWCCNVRNHTGLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.64
Topological Polar Surface Area 37.3
Polarizability 17.47
Ring Count 2
Rotatable Bond Count 2

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