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1191-43-1 | 1,6-Dimercaptohexane
CAS No: 1191-43-1 Catalog No: AG000I6L MDL No:MFCD00004910
Product Description
Catalog Number:
AG000I6L
Chemical Name:
1,6-Dimercaptohexane
CAS Number:
1191-43-1
Molecular Formula:
C6H14S2
Molecular Weight:
150.3054
MDL Number:
MFCD00004910
IUPAC Name:
hexane-1,6-dithiol
InChI:
InChI=1S/C6H14S2/c7-5-3-1-2-4-6-8/h7-8H,1-6H2
InChI Key:
SRZXCOWFGPICGA-UHFFFAOYSA-N
SMILES:
SCCCCCCS
EC Number:
214-735-1
UNII:
RWN7RM884E
NSC Number:
29031
FEMA Number:
3495
Properties
Complexity:
31.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.054g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
150.298g/mol
Monoisotopic Mass:
150.054g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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