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179308-40-8 | Benzene, 1-methoxy-4-methyl-2-(phenylmethyl)-
CAS No: 179308-40-8 Catalog No: AG0026WU MDL No:
Product Description
Catalog Number:
AG0026WU
Chemical Name:
Benzene, 1-methoxy-4-methyl-2-(phenylmethyl)-
CAS Number:
179308-40-8
Molecular Formula:
C15H16O
Molecular Weight:
212.2869
IUPAC Name:
2-benzyl-1-methoxy-4-methylbenzene
InChI:
InChI=1S/C15H16O/c1-12-8-9-15(16-2)14(10-12)11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
InChI Key:
ODNXHKMSRCTHII-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Cc1ccccc1)C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.12g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.292g/mol
Monoisotopic Mass:
212.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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