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Home > Aldehydes > 259809-67-1
259809-67-1 | 4-Oxazolecarboxaldehyde, 2-[(1E)-2-phenylethenyl]-
CAS No: 259809-67-1 Catalog No: AG002RAI MDL No:
Product Description
Catalog Number:
AG002RAI
Chemical Name:
4-Oxazolecarboxaldehyde, 2-[(1E)-2-phenylethenyl]-
CAS Number:
259809-67-1
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
IUPAC Name:
2-(2-phenylethenyl)-1,3-oxazole-4-carbaldehyde
InChI:
InChI=1S/C12H9NO2/c14-8-11-9-15-12(13-11)7-6-10-4-2-1-3-5-10/h1-9H
InChI Key:
DIPCBOKEESSSLI-UHFFFAOYSA-N
SMILES:
O=Cc1coc(n1)/C=C/c1ccccc1
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.063g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.209g/mol
Monoisotopic Mass:
199.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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