AG002WO6

288246-16-2 | 4-Bromo-2H-pyrazole-3-carbonitrile

AG002WO6

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CAS Number	288246-16-2
Catalog Number	AG002WO6(AGN-PC-0KK78B)
Chemical Name	4-Bromo-2H-pyrazole-3-carbonitrile
IUPAC Name	4-bromo-1H-pyrazole-5-carbonitrile
InChI	InChI=1S/C4H2BrN3/c5-3-2-7-8-4(3)1-6/h2H,(H,7,8)
InChI Key	ZXVFKQRZKKGVNJ-UHFFFAOYSA-N
MDL Number	MFCD00105683
Molecular Formula	C4H2BrN3
Molecular Weight	171.9828
SMILES	N#Cc1n[nH]cc1Br
Synonyms	4-bromo-1H-pyrazole-3-carbonitrile, 288246-16-2, 4-Bromo-2H-pyrazole-3-carbonitrile, 4-bromo-1H-pyrazole-5-carbonitrile, 4-Bromopyrazole-3-carbonitrile, 4-Bromo-3-cyano-1H-pyrazole, 1H-Pyrazole-3-carbonitrile, 4-bromo-, GEO-00562, MFCD00105683, 916791-70-3, PubChem10182, ACMC-20aa8h, AC1MC3QG, Maybridge1_006470, C4H2BrN3, AC1Q24HM, AC1Q25CI, KSC497K2J, SCHEMBL581659, CTK3J7524, CTK5H0319, HMS559O02, KS-00000NYT, ZXVFKQRZKKGVNJ-UHFFFAOYSA-N, BCP23452, BUTTPARK 181\04-37, ZINC4216077, ZX-AT002507, ANW-64191, MFCD06245535, OR2487, SBB088563, 4-bromo-1 h-pyrazole-3-carbonitrile, 1H-Pyrazole-5-carbonitrile,4-bromo-, AKOS005145574, AKOS006228371, AKOS025394604, AC-8260, AN-8196, CB-3434, CS-W019842, FCH1411529, FS-1748, MCULE-3811146696, PS-4370, QC-4020, RP02693, RTC-064441, TRA0090303, ACM288246162, AJ-48979, AJ-48980, AK-25711, BC003512, BP-10302, BR-25711, CJ-11578, CJ-11579, SC-03145, 4-Bromo-1H-pyrazole-3-carbonitrile, 97%, AB0023979, DB-032386, ST2418140, TC-064441, TC-152936, 4CH-015806, A5432, FT-0083400, FT-0617706, W5148, 246B162, C-57132, I11-0295, J-017283, J-514548, S14-1903, I14-12909, ZINC01323637, ACN-025175, CB10239, CID2735623, C-1131, 4-bromo-1H-pyrazole-3-carbonitrile, 95% - 1G 1g,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.943g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.985g/mol
Monoisotopic Mass	170.943g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number