AG0032AD

56621-93-3 | 2-Pyrimidinecarbonitrile, 5-amino- (9CI)

AG0032AD

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CAS Number	56621-93-3
Catalog Number	AG0032AD(AGN-PC-0NI47R)
Chemical Name	2-Pyrimidinecarbonitrile, 5-amino- (9CI)
IUPAC Name	5-aminopyrimidine-2-carbonitrile
InChI	InChI=1S/C5H4N4/c6-1-5-8-2-4(7)3-9-5/h2-3H,7H2
InChI Key	NOMODHWDBMCWFQ-UHFFFAOYSA-N
MDL Number	MFCD08234877
Molecular Formula	C5H4N4
Molecular Weight	120.1121
SMILES	N#Cc1ncc(cn1)N
Synonyms	5-Aminopyrimidine-2-carbonitrile, 56621-93-3, 5-Amino-2-cyanopyrimidine, carbonitrile, 5-amino-2-pyrimidinecarbonitrile, 5-Aminopyrimidine-2-, 2-PYRIMIDINECARBONITRILE, 5-AMINO-, PubChem9739, 2-Pyrimidinecarbonitrile, 5-amino- (9CI), 2-cyano-5aminopyrimidine, 2-Cyano-5-pyrimidinamine, 2-Cyano-5-aminopyrimidine, SCHEMBL254689, 5-azanylpyrimidine-2-carbonitrile, DTXSID30480851, NOMODHWDBMCWFQ-UHFFFAOYSA-N, 2-Pyrimidinecarbonitrile,5-amino-, MFCD08234877, ZINC38339179, AKOS006287194, AC-2956, PB15970, QC-5571, 2-Pyrimidinecarbonitrile,5-amino-(9ci), AN-13481, AS-33712, SC-05395, AB0096249, AB1001610, ST1141035, TC-307871, CS-0044715, FT-0646339, Q-1886, A831123, I03-0205, null, CS-T-03435, 22348-32-9,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	120.044g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	120.115g/mol
Monoisotopic Mass	120.044g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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