methyl 3-ethynylbicyclo[1.1.1]pentane-1-carboxylate

methyl 3-ethynylbicyclo[1.1.1]pentane-1-carboxylate

CAS: 1955554-75-2

Formula: C9H10O2

SMILES: COC(=O)C12CC(C1)(C2)C#C

IUPAC: methyl 3-ethynylbicyclo[1.1.1]pentane-1-carboxylate

InChI: InChI=1S/C9H10O2/c1-3-8-4-9(5-8,6-8)7(10)11-2/h1H,4-6H2,2H3

Composition: C (71.98%), H (6.71%), O (21.31%)

Molar Mass: 150.177

Atom Count: 21

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	150.068079562
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	WUJSGGLKTHKEOJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.6
Topological Polar Surface Area	26.3
Polarizability	15.53
Ring Count	2
Rotatable Bond Count	2

Suppliers

Coreychem

Supplier Profile

Purity	LeadTime	CAS		UnitPrice
97%	<10 Days	1955554-75-2		Quote Only

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

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1955554-75-2		$244.63-$1,008.80$244.63$392.17$673.37$1,008.80