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Home > Aldehydes > 885270-60-0
885270-60-0 | 1,3,4-Oxadiazole-2-carbaldehyde
CAS No: 885270-60-0 Catalog No: AG004773 MDL No:MFCD08234699
Product Description
Catalog Number:
AG004773
Chemical Name:
1,3,4-Oxadiazole-2-carbaldehyde
CAS Number:
885270-60-0
Molecular Formula:
C3H2N2O2
Molecular Weight:
98.0602
MDL Number:
MFCD08234699
IUPAC Name:
1,3,4-oxadiazole-2-carbaldehyde
InChI:
InChI=1S/C3H2N2O2/c6-1-3-5-4-2-7-3/h1-2H
InChI Key:
JRHGBKDABZXVDJ-UHFFFAOYSA-N
SMILES:
O=Cc1nnco1
Properties
Complexity:
75.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.012g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.061g/mol
Monoisotopic Mass:
98.012g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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