Home Nitriles 5-Hydroxy-2-pyrimidinecarbonitrile

5-Hydroxy-2-pyrimidinecarbonitrile

CAS No.:
345642-86-6
Catalog Number:
AG00C6ZL
Molecular Formula:
C5H3N3O
Molecular Weight:
121.0968
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Product Description
Catalog Number:
AG00C6ZL
Chemical Name:
5-Hydroxy-2-pyrimidinecarbonitrile
CAS Number:
345642-86-6
Molecular Formula:
C5H3N3O
Molecular Weight:
121.0968
MDL Number:
MFCD09608098
IUPAC Name:
5-hydroxypyrimidine-2-carbonitrile
InChI:
InChI=1S/C5H3N3O/c6-1-5-7-2-4(9)3-8-5/h2-3,9H
InChI Key:
UFZDLOQYHSUCOS-UHFFFAOYSA-N
SMILES:
N#Cc1ncc(cn1)O
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.028g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
121.099g/mol
Monoisotopic Mass:
121.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties