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73916-05-9 | Benzoxazole,5-methyl-2-(2-phenylethenyl)-
CAS No: 73916-05-9 Catalog No: AG005VSF MDL No:
Product Description
Catalog Number:
AG005VSF
Chemical Name:
Benzoxazole,5-methyl-2-(2-phenylethenyl)-
CAS Number:
73916-05-9
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
IUPAC Name:
5-methyl-2-[(E)-2-phenylethenyl]-1,3-benzoxazole
InChI:
InChI=1S/C16H13NO/c1-12-7-9-15-14(11-12)17-16(18-15)10-8-13-5-3-2-4-6-13/h2-11H,1H3/b10-8+
InChI Key:
PUHLHLQBIFRKRD-CSKARUKUSA-N
SMILES:
Cc1ccc2c(c1)nc(o2)/C=C/c1ccccc1
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
235.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.286g/mol
Monoisotopic Mass:
235.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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