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141063-21-0 | 1,3,9-Decatriene, 2-methyl-, (E)- (9CI)
CAS No: 141063-21-0 Catalog No: AG001FSV MDL No:
Product Description
Catalog Number:
AG001FSV
Chemical Name:
1,3,9-Decatriene, 2-methyl-, (E)- (9CI)
CAS Number:
141063-21-0
Molecular Formula:
C11H18
Molecular Weight:
150.2606
IUPAC Name:
2-methyldeca-1,3,9-triene
InChI:
InChI=1S/C11H18/c1-4-5-6-7-8-9-10-11(2)3/h4,9-10H,1-2,5-8H2,3H3
InChI Key:
GGQFKRJSXPRLGL-UHFFFAOYSA-N
SMILES:
C=CCCCC/C=C/C(=C)C
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.141g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.265g/mol
Monoisotopic Mass:
150.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.8
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