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101339-96-2 | 2,5,8-Undecatrien-1-ol, (2E,5Z,8Z)-
CAS No: 101339-96-2 Catalog No: AG000494 MDL No:
Product Description
Catalog Number:
AG000494
Chemical Name:
2,5,8-Undecatrien-1-ol, (2E,5Z,8Z)-
CAS Number:
101339-96-2
Molecular Formula:
C11H18O
Molecular Weight:
166.2600
IUPAC Name:
undeca-2,5,8-trien-1-ol
InChI:
InChI=1S/C11H18O/c1-2-3-4-5-6-7-8-9-10-11-12/h3-4,6-7,9-10,12H,2,5,8,11H2,1H3
InChI Key:
GQHVUIIYRRZKCN-UHFFFAOYSA-N
SMILES:
CC/C=C\C/C=C\C/C=C/CO
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.264g/mol
Monoisotopic Mass:
166.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
2.7
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