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823235-30-9 | Propanoic acid, 3-(propyltetrathio)-
CAS No: 823235-30-9 Catalog No: AG005DXV MDL No:
Product Description
Catalog Number:
AG005DXV
Chemical Name:
Propanoic acid, 3-(propyltetrathio)-
CAS Number:
823235-30-9
Molecular Formula:
C6H12O2S4
Molecular Weight:
244.4183
IUPAC Name:
3-(propyltetrasulfanyl)propanoic acid
InChI:
InChI=1S/C6H12O2S4/c1-2-4-9-11-12-10-5-3-6(7)8/h2-5H2,1H3,(H,7,8)
InChI Key:
YOROJHCGNWIOBM-UHFFFAOYSA-N
SMILES:
CCCSSSSCCC(=O)O
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.972g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.4g/mol
Monoisotopic Mass:
243.972g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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