tert-butyl N-[(2S)-1-hydroxy-4-(methylsulfanyl)butan-2-yl]carbamate

tert-butyl N-[(2S)-1-hydroxy-4-(methylsulfanyl)butan-2-yl]carbamate

CAS: 51372-93-1

Formula: C10H21NO3S

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

IUPAC: tert-butyl N-[(2S)-1-hydroxy-4-(methylsulfanyl)butan-2-yl]carbamate

InChI: InChI=1S/C10H21NO3S/c1-10(2,3)14-9(13)11-8(7-12)5-6-15-4/h8,12H,5-7H2,1-4H3,(H,11,13)/t8-/m0/s1

Composition: C (51.04%), H (8.99%), N (5.95%), O (20.39%), S (13.62%)

Molar Mass: 235.34

Atom Count: 36

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	235.124214714
Formal Charge	0
FSP3	0.9
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	IPIBDQMAIDPJBU-QMMMGPOBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.59
Topological Polar Surface Area	58.56
Polarizability	24.76
Ring Count	0
Rotatable Bond Count	7

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