(2R)-2-amino-3-(tert-butylsulfanyl)propanoic acid chloride

(2R)-2-amino-3-(tert-butylsulfanyl)propanoic acid chloride

CAS: 2481-09-6

Formula: C7H15ClNO2S

SMILES: [Cl-].CC(C)(C)SC[C@H](N)C(O)=O

IUPAC: (2R)-2-amino-3-(tert-butylsulfanyl)propanoic acid chloride

InChI: InChI=1S/C7H15NO2S.ClH/c1-7(2,3)11-4-5(8)6(9)10;/h5H,4,8H2,1-3H3,(H,9,10);1H/p-1/t5-;/m0./s1

Composition: C (39.53%), H (7.11%), Cl (16.67%), N (6.58%), O (15.04%), S (15.07%)

Molar Mass: 212.71

Atom Count: 27

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	212.0517512
Formal Charge	-1
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	MHBMYFJKEBCMDR-JEDNCBNOSA-M
Lipinski's Rule of Five	1
Molar Refractivity	46.83
Topological Polar Surface Area	63.32
Polarizability	18.74
Ring Count	0
Rotatable Bond Count	4

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