2-(adamantan-1-yl)ethyl acetate

2-(adamantan-1-yl)ethyl acetate

CAS: 29817-45-6

Formula: C14H22O2

SMILES: CC(=O)OCCC12CC3CC(CC(C3)C1)C2

IUPAC: 2-(adamantan-1-yl)ethyl acetate

InChI: InChI=1S/C14H22O2/c1-10(15)16-3-2-14-7-11-4-12(8-14)6-13(5-11)9-14/h11-13H,2-9H2,1H3

Composition: C (75.63%), H (9.97%), O (14.39%)

Molar Mass: 222.328

Atom Count: 38

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	222.161979948
Formal Charge	0
FSP3	0.93
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	YTFCITZYEJCLAO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.35
Topological Polar Surface Area	26.3
Polarizability	25.09
Ring Count	3
Rotatable Bond Count	4

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