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89268-08-6 | 1,3,5-Octatriene, 1-methoxy-, (E,E,E)-
CAS No: 89268-08-6 Catalog No: AG0041JM MDL No:
Product Description
Catalog Number:
AG0041JM
Chemical Name:
1,3,5-Octatriene, 1-methoxy-, (E,E,E)-
CAS Number:
89268-08-6
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
1-methoxyocta-1,3,5-triene
InChI:
InChI=1S/C9H14O/c1-3-4-5-6-7-8-9-10-2/h4-9H,3H2,1-2H3
InChI Key:
IHOWRNFPMVYZIN-UHFFFAOYSA-N
SMILES:
CC/C=C/C=C/C=C/OC
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
2.8
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