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140670-07-1 | 1,6,11-Dodecatriene, 6-(methoxymethyl)-2,10-dimethyl-
CAS No: 140670-07-1 Catalog No: AG001CNK MDL No:
Product Description
Catalog Number:
AG001CNK
Chemical Name:
1,6,11-Dodecatriene, 6-(methoxymethyl)-2,10-dimethyl-
CAS Number:
140670-07-1
Molecular Formula:
C16H28O
Molecular Weight:
236.3929
IUPAC Name:
6-(methoxymethyl)-2,10-dimethyldodeca-1,6,11-triene
InChI:
InChI=1S/C16H28O/c1-6-15(4)10-8-12-16(13-17-5)11-7-9-14(2)3/h6,12,15H,1-2,7-11,13H2,3-5H3
InChI Key:
XGLMIYWJMQSHDQ-UHFFFAOYSA-N
SMILES:
COCC(=CCCC(C=C)C)CCCC(=C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.214g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.399g/mol
Monoisotopic Mass:
236.214g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
5.6
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