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382631-43-8 | Octane-1,2,8-triol
CAS No: 382631-43-8 Catalog No: AG003DBM MDL No:MFCD02093484
Product Description
Catalog Number:
AG003DBM
Chemical Name:
Octane-1,2,8-triol
CAS Number:
382631-43-8
Molecular Formula:
C8H18O3
Molecular Weight:
162.2267
MDL Number:
MFCD02093484
IUPAC Name:
octane-1,2,8-triol
InChI:
InChI=1S/C8H18O3/c9-6-4-2-1-3-5-8(11)7-10/h8-11H,1-7H2
InChI Key:
GKCGJDQACNSNBB-UHFFFAOYSA-N
SMILES:
OCCCCCCC(CO)O
Properties
Complexity:
75.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.126g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
162.229g/mol
Monoisotopic Mass:
162.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Molecular basis for synergistic transcriptional activation by Oct1 and Sox2 revealed from the solution structure of the 42-kDa Oct1.Sox2.Hoxb1-DNA ternary transcription factor complex. | The Journal of biological chemistry 20040109 |
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