2-[N-methyl-3-(methyldisulfanyl)propanamido]propanoic acid

2-[N-methyl-3-(methyldisulfanyl)propanamido]propanoic acid

Formula: C8H15NO3S2

SMILES: CSSCCC(=O)N(C)C(C)C(O)=O

IUPAC: 2-[N-methyl-3-(methyldisulfanyl)propanamido]propanoic acid

InChI: InChI=1/C8H15NO3S2/c1-6(8(11)12)9(2)7(10)4-5-14-13-3/h6H,4-5H2,1-3H3,(H,11,12)

Composition: C (40.49%), H (6.37%), N (5.90%), O (20.22%), S (27.02%)

Molar Mass: 237.33

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	237.049335695
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	OPKAUPROPWPLTQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.1
Topological Polar Surface Area	57.61
Polarizability	23.42
Ring Count	0
Rotatable Bond Count	6

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H15NO3S2		Quote Only