ethyl (1R,5S)-3-oxobicyclo[3.1.0]hexane-6-carboxylate

ethyl (1R,5S)-3-oxobicyclo[3.1.0]hexane-6-carboxylate

CAS: 1312536-44-9

Formula: C9H12O3

SMILES: CCOC(=O)C1[C@H]2CC(=O)C[C@@H]12

IUPAC: ethyl (1R,5S)-3-oxobicyclo[3.1.0]hexane-6-carboxylate

InChI: InChI=1S/C9H12O3/c1-2-12-9(11)8-6-3-5(10)4-7(6)8/h6-8H,2-4H2,1H3/t6-,7+,8?

Composition: C (64.27%), H (7.19%), O (28.54%)

Molar Mass: 168.192

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	168.078644246
Formal Charge	0
FSP3	0.78
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KWLBCWQUIUVLCR-DHBOJHSNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.1
Topological Polar Surface Area	43.37
Polarizability	16.73
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1312536-44-9		$276.16-$1,134.90$276.16$441.35$756.60$1,134.90