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402745-81-7 | 2-ETHYL-5-PHENYL-BENZOXAZOLE
CAS No: 402745-81-7 Catalog No: AG0073RW MDL No:
Product Description
Catalog Number:
AG0073RW
Chemical Name:
2-ETHYL-5-PHENYL-BENZOXAZOLE
CAS Number:
402745-81-7
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
2-ethyl-5-phenyl-1,3-benzoxazole
InChI:
InChI=1S/C15H13NO/c1-2-15-16-13-10-12(8-9-14(13)17-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3
InChI Key:
AEADBBUECVLTRS-UHFFFAOYSA-N
SMILES:
CCc1oc2c(n1)cc(cc2)c1ccccc1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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