AG000XBZ

1277179-33-5 | 5-Pyrimidinecarbonitrile, 2-amino-4,6-dichloro-

AG000XBZ

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CAS Number	1277179-33-5
Catalog Number	AG000XBZ(AGN-PC-0WD6T2)
Chemical Name	5-Pyrimidinecarbonitrile, 2-amino-4,6-dichloro-
IUPAC Name	2-amino-4,6-dichloropyrimidine-5-carbonitrile
InChI	InChI=1S/C5H2Cl2N4/c6-3-2(1-8)4(7)11-5(9)10-3/h(H2,9,10,11)
InChI Key	UGPXXWQEKARQTD-UHFFFAOYSA-N
MDL Number	MFCD20727436
Molecular Formula	C5H2Cl2N4
Molecular Weight	189.0022
SMILES	N#CC1=C(Cl)N=C(N)N=C1Cl
Synonyms	2-amino-4,6-dichloropyrimidine-5-carbonitrile, 1277179-33-5, SCHEMBL17458364, KS-00000SRV, MFCD20727436, ZINC96028383, FCH1310162, OR17955, AK317595, DS-11513, CS-0045711, 5-Pyrimidinecarbonitrile, 2-amino-4,6-dichloro-,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.966g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.999g/mol
Monoisotopic Mass	187.966g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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