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89015-46-3 | Benzene, 4-(1,5-dimethyl-4-hexenyl)-2-methoxy-1-methyl-
CAS No: 89015-46-3 Catalog No: AG0044DO MDL No:
Product Description
Catalog Number:
AG0044DO
Chemical Name:
Benzene, 4-(1,5-dimethyl-4-hexenyl)-2-methoxy-1-methyl-
CAS Number:
89015-46-3
Molecular Formula:
C16H24O
Molecular Weight:
232.3612
IUPAC Name:
2-methoxy-1-methyl-4-(6-methylhept-5-en-2-yl)benzene
InChI:
InChI=1S/C16H24O/c1-12(2)7-6-8-13(3)15-10-9-14(4)16(11-15)17-5/h7,9-11,13H,6,8H2,1-5H3
InChI Key:
JWJQHRNETMWLFY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1C)C(CCC=C(C)C)C
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.367g/mol
Monoisotopic Mass:
232.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Literature
| Title | Journal |
|---|---|
| Inhibitory effects of compounds from Zingiberaceae species on platelet activating factor receptor binding. | Phytotherapy research : PTR 20041201 |
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