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100419-52-1 | 7-Octadecene, 18,18-dimethoxy-, (7Z)-
CAS No: 100419-52-1 Catalog No: AG0001Y6 MDL No:
Product Description
Catalog Number:
AG0001Y6
Chemical Name:
7-Octadecene, 18,18-dimethoxy-, (7Z)-
CAS Number:
100419-52-1
Molecular Formula:
C20H40O2
Molecular Weight:
312.5304
IUPAC Name:
18,18-dimethoxyoctadec-7-ene
InChI:
InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21-2)22-3/h9-10,20H,4-8,11-19H2,1-3H3
InChI Key:
PRRQPKCMINTHFK-UHFFFAOYSA-N
SMILES:
CCCCCC/C=C\CCCCCCCCCC(OC)OC
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.303g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.538g/mol
Monoisotopic Mass:
312.303g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
8
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