1-hydroxycycloheptane-1-carboxylic acid

1-hydroxycycloheptane-1-carboxylic acid

CAS: 20920-03-0

Formula: C8H14O3

SMILES: OC(=O)C1(O)CCCCCC1

IUPAC: 1-hydroxycycloheptane-1-carboxylic acid

InChI: InChI=1S/C8H14O3/c9-7(10)8(11)5-3-1-2-4-6-8/h11H,1-6H2,(H,9,10)

Composition: C (60.74%), H (8.92%), O (30.34%)

Molar Mass: 158.197

Atom Count: 25

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	158.094294311
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	IVOHSGDSPNQSDJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40
Topological Polar Surface Area	57.53
Polarizability	15.92
Ring Count	1
Rotatable Bond Count	1

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