Home Aldehydes 4-Pyrimidinecarboxaldehyde, oxime (7CI,8CI,9CI)

4-Pyrimidinecarboxaldehyde, oxime (7CI,8CI,9CI)

CAS No.:
1073-65-0
Catalog Number:
AG0094OA
Molecular Formula:
C5H5N3O
Molecular Weight:
123.1127
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Product Description
Catalog Number:
AG0094OA
Chemical Name:
4-Pyrimidinecarboxaldehyde, oxime (7CI,8CI,9CI)
CAS Number:
1073-65-0
Molecular Formula:
C5H5N3O
Molecular Weight:
123.1127
MDL Number:
MFCD18820951
IUPAC Name:
(NE)-N-(pyrimidin-4-ylmethylidene)hydroxylamine
InChI:
InChI=1S/C5H5N3O/c9-8-3-5-1-2-6-4-7-5/h1-4,9H/b8-3+
InChI Key:
PUVYLIOTFMFXOB-FPYGCLRLSA-N
SMILES:
O/N=C/c1ccncn1
Properties
Complexity:
104  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
123.043g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
123.115g/mol
Monoisotopic Mass:
123.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties