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118994-86-8 | Oxazole-5-carbaldehyde
CAS No: 118994-86-8 Catalog No: AG007R79 MDL No:MFCD02179513
Product Description
Catalog Number:
AG007R79
Chemical Name:
Oxazole-5-carbaldehyde
CAS Number:
118994-86-8
Molecular Formula:
C4H3NO2
Molecular Weight:
97.0721
MDL Number:
MFCD02179513
IUPAC Name:
1,3-oxazole-5-carbaldehyde
InChI:
InChI=1S/C4H3NO2/c6-2-4-1-5-3-7-4/h1-3H
InChI Key:
YOFJBRZKRZUDGB-UHFFFAOYSA-N
SMILES:
O=Cc1cnco1
Properties
Complexity:
74.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.016g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.073g/mol
Monoisotopic Mass:
97.016g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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