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80901-86-6 | BIS(6-HYDROXYHEXYL)DISULFIDE
CAS No: 80901-86-6 Catalog No: AG005IAA MDL No:
Product Description
Catalog Number:
AG005IAA
Chemical Name:
BIS(6-HYDROXYHEXYL)DISULFIDE
CAS Number:
80901-86-6
Molecular Formula:
C12H26O2S2
Molecular Weight:
266.4636
IUPAC Name:
6-(6-hydroxyhexyldisulfanyl)hexan-1-ol
InChI:
InChI=1S/C12H26O2S2/c13-9-5-1-3-7-11-15-16-12-8-4-2-6-10-14/h13-14H,1-12H2
InChI Key:
HPKCPHUCATZKGA-UHFFFAOYSA-N
SMILES:
OCCCCCCSSCCCCCCO
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.458g/mol
Monoisotopic Mass:
266.137g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
91.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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