tert-butyl N-[(2S)-1-(methanesulfonyloxy)propan-2-yl]carbamate

tert-butyl N-[(2S)-1-(methanesulfonyloxy)propan-2-yl]carbamate

CAS: 126301-16-4

Formula: C9H19NO5S

SMILES: C[C@@H](COS(C)(=O)=O)NC(=O)OC(C)(C)C

IUPAC: tert-butyl N-[(2S)-1-(methanesulfonyloxy)propan-2-yl]carbamate

InChI: InChI=1S/C9H19NO5S/c1-7(6-14-16(5,12)13)10-8(11)15-9(2,3)4/h7H,6H2,1-5H3,(H,10,11)/t7-/m0/s1

Composition: C (42.67%), H (7.56%), N (5.53%), O (31.58%), S (12.66%)

Molar Mass: 253.31

Atom Count: 35

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	253.09839389
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NLKBUJQLMRHSKP-ZETCQYMHSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.26
Topological Polar Surface Area	81.7
Polarizability	24.22
Ring Count	0
Rotatable Bond Count	6

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