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101097-11-4 | 2-(2-Methoxyphenyl)-5-methylbenzo[d]oxazole
CAS No: 101097-11-4 Catalog No: AG0003QL MDL No:
Product Description
Catalog Number:
AG0003QL
Chemical Name:
2-(2-Methoxyphenyl)-5-methylbenzo[d]oxazole
CAS Number:
101097-11-4
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
2-(2-methoxyphenyl)-5-methyl-1,3-benzoxazole
InChI:
InChI=1S/C15H13NO2/c1-10-7-8-14-12(9-10)16-15(18-14)11-5-3-4-6-13(11)17-2/h3-9H,1-2H3
InChI Key:
XWYGZQSGNQEHLA-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1nc2c(o1)ccc(c2)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Synthesis and microbiological activity of some novel 5- or 6-methyl-2-(2,4-disubstituted phenyl) benzoxazole derivatives. | Farmaco (Societa chimica italiana : 1989) 19980530 |
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