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811784-15-3 | Benzene,1-[(4-methoxyphenyl)methyl]-2,4-dimethyl-
CAS No: 811784-15-3 Catalog No: AG005FCX MDL No:
Product Description
Catalog Number:
AG005FCX
Chemical Name:
Benzene,1-[(4-methoxyphenyl)methyl]-2,4-dimethyl-
CAS Number:
811784-15-3
Molecular Formula:
C16H18O
Molecular Weight:
226.3135
IUPAC Name:
1-[(4-methoxyphenyl)methyl]-2,4-dimethylbenzene
InChI:
InChI=1S/C16H18O/c1-12-4-7-15(13(2)10-12)11-14-5-8-16(17-3)9-6-14/h4-10H,11H2,1-3H3
InChI Key:
VINBEKQZAXWGCO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Cc1ccc(cc1C)C
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.136g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.319g/mol
Monoisotopic Mass:
226.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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