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1633-90-5 | 3-HEXANETHIOL
CAS No: 1633-90-5 Catalog No: AG001U08 MDL No:MFCD00053517
Product Description
Catalog Number:
AG001U08
Chemical Name:
3-HEXANETHIOL
CAS Number:
1633-90-5
Molecular Formula:
C6H14S
Molecular Weight:
118.2404
MDL Number:
MFCD00053517
IUPAC Name:
hexane-3-thiol
InChI:
InChI=1S/C6H14S/c1-3-5-6(7)4-2/h6-7H,3-5H2,1-2H3
InChI Key:
VOIGMFQJDZTEKW-UHFFFAOYSA-N
SMILES:
CCCC(CC)S
EC Number:
216-650-5
Properties
Complexity:
35.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.082g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
118.238g/mol
Monoisotopic Mass:
118.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| DNA recognition interfaces: the influence of interfacial design on the efficiency and kinetics of hybridization. | Langmuir : the ACS journal of surfaces and colloids 20050719 |
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