AG000II6

119270-27-8 | Pyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, 7-amino-

AG000II6

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CAS Number	119270-27-8
Catalog Number	AG000II6(AGN-PC-0JVGL5)
Chemical Name	Pyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, 7-amino-
IUPAC Name	7-aminopyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile
InChI	InChI=1S/C8H4N6/c9-1-5-3-12-8-6(2-10)4-13-14(8)7(5)11/h3-4H,11H2
InChI Key	NXEKAPRNZKNMOD-UHFFFAOYSA-N
MDL Number	MFCD01812292
Molecular Formula	C8H4N6
Molecular Weight	184.1576
SMILES	NC1N2C(=C(C=N2)C#N)N=CC=1C#N
Synonyms	7-aminopyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, 119270-27-8, Pyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, 7-amino-, 7-amino-8-hydropyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, ZERO/008096, ACMC-20dlw7, AC1LF3QW, Oprea1_785010, CTK0F9589, RSCBB000775, DTXSID00352298, ZINC126529, KS-00000E8Z, ZX-AT014441, 6473AJ, FCH922454, MFCD01812292, RSC006503, SBB001483, STK350909, AKOS003268115, MCULE-1313933117, OR13390, TRA0018046, AS-31860, CJ-00950, ST014683, SY021430, TC-308014, CS-0080346, EN300-230790, Z-4616, MFCD01812292 (97+%), SR-01000526903, SR-01000526903-1, 7-Amino-3-cyanopyrazolo[1,5-a]pyrimidin-6-yl cyanide, C8H4N6, NXEKAPRNZKNMOD-UHFFFAOYSA-N, CID722521, 7-amino-Pyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile, 18880-04-1,

Complexity	321
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.05g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	184.162g/mol
Monoisotopic Mass	184.05g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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