methyl 3-(2-hydroxyethyl)bicyclo[1.1.1]pentane-1-carboxylate

methyl 3-(2-hydroxyethyl)bicyclo[1.1.1]pentane-1-carboxylate

CAS: 1113001-65-2

Formula: C9H14O3

SMILES: COC(=O)C12CC(CCO)(C1)C2

IUPAC: methyl 3-(2-hydroxyethyl)bicyclo[1.1.1]pentane-1-carboxylate

InChI: InChI=1S/C9H14O3/c1-12-7(11)9-4-8(5-9,6-9)2-3-10/h10H,2-6H2,1H3

Composition: C (63.51%), H (8.29%), O (28.20%)

Molar Mass: 170.208

Atom Count: 26

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	170.094294311
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KXKXBPHTIRVECF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.06
Topological Polar Surface Area	46.53
Polarizability	17.27
Ring Count	2
Rotatable Bond Count	4

Suppliers

Coreychem

Supplier Profile

Purity	LeadTime	CAS		UnitPrice
97%	<10 Days	1113001-65-2		Quote Only

Custom Synthesis. Higher purity available. Multi gram to multi kg