1-cyanocycloheptyl acetate

1-cyanocycloheptyl acetate

CAS: 71172-45-7

Formula: C10H15NO2

SMILES: CC(=O)OC1(CCCCCC1)C#N

IUPAC: 1-cyanocycloheptyl acetate

InChI: InChI=1S/C10H15NO2/c1-9(12)13-10(8-11)6-4-2-3-5-7-10/h2-7H2,1H3

Composition: C (66.27%), H (8.34%), N (7.73%), O (17.66%)

Molar Mass: 181.235

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	181.110278727
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CDDMHDQXVZILGM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.13
Topological Polar Surface Area	50.09
Polarizability	19.04
Ring Count	1
Rotatable Bond Count	2

Suppliers

Frinton Laboratories, Inc.

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<10 Days	71172-45-7		$49.50-$198.00$49.50$198.00

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