AG005003

822-69-5 | 1,2,4-Triazin-5-amine

AG005003

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CAS Number	822-69-5
Catalog Number	AG005003(AGN-PC-03N9YZ)
Chemical Name	1,2,4-Triazin-5-amine
IUPAC Name	1,2,4-triazin-5-amine
InChI	InChI=1S/C3H4N4/c4-3-1-6-7-2-5-3/h1-2H,(H2,4,5,7)
InChI Key	XULSZEJIHQWWEB-UHFFFAOYSA-N
MDL Number	MFCD19204976
Molecular Formula	C3H4N4
Molecular Weight	96.0907
SMILES	NC1=CN=NC=N1
Synonyms	1,2,4-Triazin-5-amine, 822-69-5, 5-amino-1,2,4-triazine, CTK3E1248, DTXSID50624270, XULSZEJIHQWWEB-UHFFFAOYSA-N, ZINC78210784, AKOS006338638, Z1962221405,

Complexity	54.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	96.044g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	96.093g/mol
Monoisotopic Mass	96.044g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	64.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group	\N
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code	\N

Certificate of Analysis

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