AG000HEG

1159981-95-9 | Pyrazolo[1,5-a]pyrimidine, 5-bromo-

AG000HEG

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CAS Number	1159981-95-9
Catalog Number	AG000HEG(AGN-PC-07CNBX)
Chemical Name	Pyrazolo[1,5-a]pyrimidine, 5-bromo-
IUPAC Name	5-bromopyrazolo[1,5-a]pyrimidine
InChI	InChI=1S/C6H4BrN3/c7-5-2-4-10-6(9-5)1-3-8-10/h1-4H
InChI Key	DIYTVASYDOBYQA-UHFFFAOYSA-N
MDL Number	MFCD11042744
Molecular Formula	C6H4BrN3
Molecular Weight	198.0201
SMILES	BrC1=NC2=CC=NN2C=C1
Synonyms	5-bromopyrazolo[1,5-a]pyrimidine, 1159981-95-9, SCHEMBL4789377, CTK4A9598, KS-00000HPN, DTXSID20670421, DIYTVASYDOBYQA-UHFFFAOYSA-N, 5-bromanylpyrazolo[1,5-a]pyrimidine, ANW-50899, MFCD11042744, ZINC64033446, AKOS006307576, CS-W005661, FS-3011, Pyrazolo[1,5-a]pyrimidine, 5-bromo-, RP25583, AK-32125, BR-32125, EN002606, QC-10367, AB0034911, AJ-114584, TR-034144, ST24029425, X9145, S-6904, A803543, J-517194, Z1695906720, 3-bromo-3-methyl-pentan, C6H4BrN3,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.959g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.023g/mol
Monoisotopic Mass	196.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	30.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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