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115412-47-0 | Hexane, 1,6-bis(ethylthio)-
CAS No: 115412-47-0 Catalog No: AG000FY4 MDL No:
Product Description
Catalog Number:
AG000FY4
Chemical Name:
Hexane, 1,6-bis(ethylthio)-
CAS Number:
115412-47-0
Molecular Formula:
C10H22S2
Molecular Weight:
206.4117
IUPAC Name:
1,6-bis(ethylsulfanyl)hexane
InChI:
InChI=1S/C10H22S2/c1-3-11-9-7-5-6-8-10-12-4-2/h3-10H2,1-2H3
InChI Key:
DGWHERIHGCCUJL-UHFFFAOYSA-N
SMILES:
CCSCCCCCCSCC
Properties
Complexity:
64.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.116g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.406g/mol
Monoisotopic Mass:
206.116g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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