(1S,3S,5S)-3-carbamoyl-2-azabicyclo[3.1.0]hexan-1-yl methanesulfonate

(1S,3S,5S)-3-carbamoyl-2-azabicyclo[3.1.0]hexan-1-yl methanesulfonate

CAS: 709031-45-8

Formula: C7H12N2O4S

SMILES: CS(=O)(=O)O[C@@]12C[C@@H]1C[C@H](N2)C(N)=O

IUPAC: (1S,3S,5S)-3-carbamoyl-2-azabicyclo[3.1.0]hexan-1-yl methanesulfonate

InChI: InChI=1S/C7H12N2O4S/c1-14(11,12)13-7-3-4(7)2-5(9-7)6(8)10/h4-5,9H,2-3H2,1H3,(H2,8,10)/t4-,5+,7+/m1/s1

Composition: C (38.17%), H (5.49%), N (12.72%), O (29.06%), S (14.56%)

Molar Mass: 220.24

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	220.051778048
Formal Charge	0
FSP3	0.86
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	QAVPLVVMWBQATF-VPLCAKHXSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.68
Topological Polar Surface Area	98.49
Polarizability	19.95
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	709031-45-8		$53.82-$1,543.19$53.82$104.54$139.73$241.16$516.47$1,543.19

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	709031-45-8		$124.20-$1,397.25$124.20$465.75$1,397.25

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	709031-45-8		$462.00-$834.00$462.00$647.00$834.00