AG000RFV

1260840-42-3 | 1,2,4-Triazolo[4,3-a]pyridine-3-carboxylic acid, 6-bromo-, ethyl ester

AG000RFV

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CAS Number	1260840-42-3
Catalog Number	AG000RFV(AGN-PC-0WAND2)
Chemical Name	1,2,4-Triazolo[4,3-a]pyridine-3-carboxylic acid, 6-bromo-, ethyl ester
IUPAC Name	ethyl 6-bromo-[1,2,4]triazolo[4,3-a]pyridine-3-carboxylate
InChI	InChI=1S/C9H8BrN3O2/c1-2-15-9(14)8-12-11-7-4-3-6(10)5-13(7)8/h3-5H,2H2,1H3
InChI Key	FGZXAJUJHNFESH-UHFFFAOYSA-N
MDL Number	MFCD11975672
Molecular Formula	C9H8BrN3O2
Molecular Weight	270.0827
SMILES	O=C(C1=NN=C2C=CC(Br)=CN21)OCC
Synonyms	Ethyl 6-bromo-[1,2,4]triazolo[4,3-a]pyridine-3-carboxylate, 1260840-42-3, ethyl 6-bromo[1,2,4]triazolo[4,3-a]pyridine-3-carboxylate, SCHEMBL17222984, FGZXAJUJHNFESH-UHFFFAOYSA-N, KS-00000S9A, MFCD11975672, ZINC83740040, AKOS014685056, DS-9286, AK150771, SC-32767, AJ-126040, CS-0041261, ETHYL 6-BROMO-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE-3-CAR, 1,2,4-Triazolo[4,3-a]pyridine-3-carboxylic acid, 6-bromo-, ethyl ester,

Complexity	252
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.98g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	270.086g/mol
Monoisotopic Mass	268.98g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	56.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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