benzyl 5-hydroxy-2-azabicyclo[4.1.0]heptane-2-carboxylate

benzyl 5-hydroxy-2-azabicyclo[4.1.0]heptane-2-carboxylate

CAS: 1799792-87-2

Formula: C14H17NO3

SMILES: OC1CCN(C2CC12)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 5-hydroxy-2-azabicyclo[4.1.0]heptane-2-carboxylate

InChI: InChI=1/C14H17NO3/c16-13-6-7-15(12-8-11(12)13)14(17)18-9-10-4-2-1-3-5-10/h1-5,11-13,16H,6-9H2

Composition: C (68.00%), H (6.93%), N (5.66%), O (19.41%)

Molar Mass: 247.294

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	3
Exact Mass	247.120843411
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NTJMTKNNINIVGA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.57
Topological Polar Surface Area	49.77
Polarizability	26.13
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1799792-87-2		$174.02-$714.99$174.02$277.42$462.79$714.99