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136789-40-7 | Ethanethiol, 2,2'-[(2-methylene-1,3-propanediyl)bis(thio)]bis- (9CI)
CAS No: 136789-40-7 Catalog No: AG0012DB MDL No:
Product Description
Catalog Number:
AG0012DB
Chemical Name:
Ethanethiol, 2,2'-[(2-methylene-1,3-propanediyl)bis(thio)]bis- (9CI)
CAS Number:
136789-40-7
Molecular Formula:
C8H16S4
Molecular Weight:
240.4726
IUPAC Name:
2-[2-(2-sulfanylethylsulfanylmethyl)prop-2-enylsulfanyl]ethanethiol
InChI:
InChI=1S/C8H16S4/c1-8(6-11-4-2-9)7-12-5-3-10/h9-10H,1-7H2
InChI Key:
VTLSJSAMMCANQX-UHFFFAOYSA-N
SMILES:
SCCSCC(=C)CSCCS
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.013g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.456g/mol
Monoisotopic Mass:
240.013g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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