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113863-89-1 | 2,4,6,8-Nonatetraen-1-ol, 9-(1-cyclohexen-1-yl)-
CAS No: 113863-89-1 Catalog No: AG0009YB MDL No:
Product Description
Catalog Number:
AG0009YB
Chemical Name:
2,4,6,8-Nonatetraen-1-ol, 9-(1-cyclohexen-1-yl)-
CAS Number:
113863-89-1
Molecular Formula:
C15H20O
Molecular Weight:
216.3187
IUPAC Name:
9-(cyclohexen-1-yl)nona-2,4,6,8-tetraen-1-ol
InChI:
InChI=1S/C15H20O/c16-14-10-5-3-1-2-4-7-11-15-12-8-6-9-13-15/h1-5,7,10-12,16H,6,8-9,13-14H2
InChI Key:
FIOAJVNOZPHVQF-UHFFFAOYSA-N
SMILES:
OCC=CC=CC=CC=CC1=CCCCC1
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.151g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.324g/mol
Monoisotopic Mass:
216.151g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
4
XLogP3:
3.7
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