2-methoxypyrimidine-5-carbonitrile


Chemical Name: 2-methoxypyrimidine-5-carbonitrile
CAS Number: 38373-47-6
Product Number: AG00CLSO(AGN-PC-02UQN4)
Synonyms:
MDL No:
Molecular Formula: C6H5N3O
Molecular Weight: 135.1234

Identification/Properties


Computed Properties
Molecular Weight:
135.126g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
135.043g/mol
Monoisotopic Mass:
135.043g/mol
Topological Polar Surface Area:
58.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
142
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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