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Home > Aldehydes > 137762-82-4
137762-82-4 | 7-Benzoxazolecarboxaldehyde, 2-phenyl-
CAS No: 137762-82-4 Catalog No: AG0013TE MDL No:
Product Description
Catalog Number:
AG0013TE
Chemical Name:
7-Benzoxazolecarboxaldehyde, 2-phenyl-
CAS Number:
137762-82-4
Molecular Formula:
C14H9NO2
Molecular Weight:
223.2268
IUPAC Name:
2-phenyl-1,3-benzoxazole-7-carbaldehyde
InChI:
InChI=1S/C14H9NO2/c16-9-11-7-4-8-12-13(11)17-14(15-12)10-5-2-1-3-6-10/h1-9H
InChI Key:
YVQBPKPDZXGVKB-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1oc(n2)c1ccccc1
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.063g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.231g/mol
Monoisotopic Mass:
223.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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