4-sulfanylpentanoic acid

4-sulfanylpentanoic acid

CAS: 125791-83-5

Formula: C5H10O2S

SMILES: CC(S)CCC(O)=O

IUPAC: 4-sulfanylpentanoic acid

InChI: InChI=1/C5H10O2S/c1-4(8)2-3-5(6)7/h4,8H,2-3H2,1H3,(H,6,7)

Composition: C (44.75%), H (7.51%), O (23.84%), S (23.89%)

Molar Mass: 134.19

Atom Count: 18

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	134.040150736
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NEAFWRKPYYJETG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.3
Topological Polar Surface Area	37.3
Polarizability	13.54
Ring Count	0
Rotatable Bond Count	3

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