(2S)-2-amino-3-(tert-butylsulfanyl)propanoic acid hydrochloride

(2S)-2-amino-3-(tert-butylsulfanyl)propanoic acid hydrochloride

CAS: 200353-65-7

Formula: C7H16ClNO2S

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

IUPAC: (2S)-2-amino-3-(tert-butylsulfanyl)propanoic acid hydrochloride

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/t5-;/m1./s1

Composition: C (39.34%), H (7.55%), Cl (16.59%), N (6.55%), O (14.97%), S (15.00%)

Molar Mass: 213.72

Atom Count: 28

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	213.0590276
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	MHBMYFJKEBCMDR-NUBCRITNSA-N
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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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	200353-65-7		$37.83$37.83