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113477-11-5 | 4,8-Dodecadien-1-ol, 12,12-dimethoxy-, (Z,Z)- (9CI)
CAS No: 113477-11-5 Catalog No: AG0008PN MDL No:
Product Description
Catalog Number:
AG0008PN
Chemical Name:
4,8-Dodecadien-1-ol, 12,12-dimethoxy-, (Z,Z)- (9CI)
CAS Number:
113477-11-5
Molecular Formula:
C14H26O3
Molecular Weight:
242.3544
IUPAC Name:
12,12-dimethoxydodeca-4,8-dien-1-ol
InChI:
InChI=1S/C14H26O3/c1-16-14(17-2)12-10-8-6-4-3-5-7-9-11-13-15/h5-8,14-15H,3-4,9-13H2,1-2H3
InChI Key:
WLUVPVZELPUFGM-UHFFFAOYSA-N
SMILES:
OCCC/C=C\CC/C=C\CCC(OC)OC
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.188g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.359g/mol
Monoisotopic Mass:
242.188g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.6
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