AG00BJNI

274-87-3 | 1,2,3,3a-Tetraaza-3aH-indene

AG00BJNI

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CAS Number	274-87-3
Catalog Number	AG00BJNI(AGN-PC-0JMOMF)
Chemical Name	1,2,3,3a-Tetraaza-3aH-indene
IUPAC Name	tetrazolo[1,5-a]pyridine
InChI	InChI=1S/C5H4N4/c1-2-4-9-5(3-1)6-7-8-9/h1-4H
InChI Key	BPDSGGQFORKTMY-UHFFFAOYSA-N
MDL Number	MFCD00829444
Molecular Formula	C5H4N4
Molecular Weight	120.1121
SMILES	C12=NN=NN1C=CC=C2
Synonyms	Tetrazolo[1,5-a]pyridine, 274-87-3, Pyridotetrazole, Tetrazolo(1,5-a)pyridine, [1,2,3,4]tetraazolo[1,5-a]pyridine, NSC838, NSC109852, AK121984, NSC 838, NSC 109852, AC1L37PT, Tetraazolo[1,5-a]pyridine, {Tetrazolo[1,5-a]pyridine}, SCHEMBL114037, 4H-tetrazolo[1,5-a]pyridine, CTK1A2582, KS-00000QRJ, DTXSID00181823, NSC-838, 1,2,3,3a-Tetraaza-3aH-indene, ZINC1587624, ZX-AT024053, FCH918834, MFCD00829444, SBB040101, AKOS000271662, DS-6411, MCULE-1723052946, NSC-109852, [1,2,3,4]tetrazolo[1,5-a]pyridine, AJ-27609, AX8240508, CS-0044087, 4-hydro-1,2,3,4-tetraazolo[1,5-a]pyridine, InChI=1/C5H4N4/c1-2-4-9-5(3-1)6-7-8-9/h1-4, CID136089,

Complexity	105
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	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	120.115g/mol
Monoisotopic Mass	120.044g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
Signal Words	warning
UN Code

Certificate of Analysis

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