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138509-53-2 | 4,11-Dodecadien-1-ol, (E)- (9CI)
CAS No: 138509-53-2 Catalog No: AG0019BV MDL No:
Product Description
Catalog Number:
AG0019BV
Chemical Name:
4,11-Dodecadien-1-ol, (E)- (9CI)
CAS Number:
138509-53-2
Molecular Formula:
C12H22O
Molecular Weight:
182.3025
IUPAC Name:
dodeca-4,11-dien-1-ol
InChI:
InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2,8-9,13H,1,3-7,10-12H2
InChI Key:
VUZKBXFOWBPOMT-UHFFFAOYSA-N
SMILES:
OCCC/C=C/CCCCCC=C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.167g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.307g/mol
Monoisotopic Mass:
182.167g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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