AG000IPG

1194-78-1 | 2,4,5-Triamino-6-chloropyrimidine

AG000IPG

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CAS Number	1194-78-1
Catalog Number	AG000IPG(AGN-PC-0JRZ0Y)
Chemical Name	2,4,5-Triamino-6-chloropyrimidine
IUPAC Name	6-chloropyrimidine-2,4,5-triamine
InChI	InChI=1S/C4H6ClN5/c5-2-1(6)3(7)10-4(8)9-2/h6H2,(H4,7,8,9,10)
InChI Key	BMCHNFZLERXZBI-UHFFFAOYSA-N
MDL Number	MFCD11114448
Molecular Formula	C4H6ClN5
Molecular Weight	159.5769
SMILES	NC1=NC(Cl)=C(N)C(N)=N1
Synonyms	6-chloropyrimidine-2,4,5-triamine, 1194-78-1, 2,4,5-TRIAMINO-6-CHLOROPYRIMIDINE, 6-chloro-2,4,5-Pyrimidinetriamine, 2,4,5-Pyrimidinetriamine, 6-chloro-, AK-28737, AC1L9T2R, SCHEMBL1512060, CTK8G6622, KS-00000IPH, 2,4,5-triamino-6-chloropyrimid, DTXSID10333331, BMCHNFZLERXZBI-UHFFFAOYSA-N, 3339AA, FCH889517, MFCD11114448, ZINC40448432, AKOS006305893, RP22302, AN-48825, DS-11134, AJ-102720, AX8017726, DB-061569, FT-0648354, ST24045326, 2,4,5-triamino-6-hydroxypyrimidine dihydrochloride, J-507049, C4H6ClN5, AIDS161817, CID500505,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	159.031g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	159.577g/mol
Monoisotopic Mass	159.031g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number