AG008ETW

87253-62-1 | 5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid

AG008ETW

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CAS Number	87253-62-1
Catalog Number	AG008ETW(AGN-PC-0JUSP5)
Chemical Name	5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid
IUPAC Name	5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid
InChI	InChI=1S/C8H8N4O2/c1-4-3-5(2)12-8(9-4)10-6(11-12)7(13)14/h3H,1-2H3,(H,13,14)
InChI Key	LIVBNPDDJKFYDF-UHFFFAOYSA-N
MDL Number	MFCD00462463
Molecular Formula	C8H8N4O2
Molecular Weight	192.1747
SMILES	O=C(C1=NN2C(C)=CC(C)=NC2=N1)O
Synonyms	5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid, 87253-62-1, 5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid, [1,2,4]Triazolo[1,5-a]pyrimidine-2-carboxylicacid, 5,7-dimethyl-, [1,2,4]Triazolo[1,5-a]pyrimidine-2-carboxylic acid, 5,7-dimethyl-, 5,7-dimethyl-8-hydro-1,2,4-triazolo[1,5-a]pyrimidine-2-carboxylic acid, 5,7-Dimethyl-[1,2,4]Triazolo[1,5-A]Pyrimidine-2-Carboxylic Acid Hydrate, BAS 10826933, AC1LDWR8, AC1Q2IF5, AC1Q2IF6, CBDivE_001724, SCHEMBL10461118, CTK3F0792, ZINC39681, DTXSID50350305, LIVBNPDDJKFYDF-UHFFFAOYSA-N, HMS1697A14, ALBB-000196, KS-00000F0C, BBL009837, MFCD00462463, SBB010865, STK500260, AKOS000114824, AKOS005169997, MCULE-6194471692, AJ-08888, AK135339, AN-35446, BS-13900, DA-02178, ST063715, AB0072283, TR-044381, BB 0237707, FT-0750259, ST24044131, V7924, EN300-00904, A-2173, 253D621, SR-01000401367, J-516567, SR-01000401367-1, F0347-4277, 5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine- 2-carboxylic acid, 5,7-dimethyl-1,2,4-triazolo[1,5-a]pyrimidin-2-carboxylic acid, 5,7-Dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid, AldrichCPR, C8H8N4O2, CID676511, 5,7-Dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid, 5,7-DIMETHYL-[1,2,4]TRIAZOLO[4,3-A]PYRIMIDINE-3-CARBOXYLICACID, 842972-32-1,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.065g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.178g/mol
Monoisotopic Mass	192.065g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	80.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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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