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1565-81-7 | 3-DECANOL
CAS No: 1565-81-7 Catalog No: AG001ORW MDL No:MFCD00021956
Product Description
Catalog Number:
AG001ORW
Chemical Name:
3-DECANOL
CAS Number:
1565-81-7
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
MDL Number:
MFCD00021956
IUPAC Name:
decan-3-ol
InChI:
InChI=1S/C10H22O/c1-3-5-6-7-8-9-10(11)4-2/h10-11H,3-9H2,1-2H3
InChI Key:
ICEQLCZWZXUUIJ-UHFFFAOYSA-N
SMILES:
CCCCCCCC(CC)O
EC Number:
605-062-8
FEMA Number:
3605
Properties
Complexity:
71.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Literature
| Title | Journal |
|---|---|
| The effect of the chemical, biological, and physical environment on quorum sensing in structured microbial communities. | Analytical and bioanalytical chemistry 20070101 |
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