1-benzylcyclopropane-1-carboxylic acid

1-benzylcyclopropane-1-carboxylic acid

CAS: 27356-91-8

Formula: C11H12O2

SMILES: OC(=O)C1(CC2=CC=CC=C2)CC1

IUPAC: 1-benzylcyclopropane-1-carboxylic acid

InChI: InChI=1S/C11H12O2/c12-10(13)11(6-7-11)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)

Composition: C (74.98%), H (6.86%), O (18.16%)

Molar Mass: 176.215

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	176.083729626
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PRZXHBOMTVGLPB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.24
Topological Polar Surface Area	37.3
Polarizability	19.31
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	27356-91-8		$372.00$372.00