2-methyl-3-sulfanylbutan-1-ol

2-methyl-3-sulfanylbutan-1-ol

CAS: 227456-33-9

Formula: C5H12OS

SMILES: CC(S)C(C)CO

IUPAC: 2-methyl-3-sulfanylbutan-1-ol

InChI: InChI=1/C5H12OS/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3

Composition: C (49.96%), H (10.06%), O (13.31%), S (26.67%)

Molar Mass: 120.21

Atom Count: 19

Heavy Atom Count: 7

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	120.06088618
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	2
InChIKey	RFMHFOPFUZZBAD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.33
Topological Polar Surface Area	20.23
Polarizability	13.61
Ring Count	0
Rotatable Bond Count	2

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