AG003M5T

328244-35-5 | 5-(4-Fluoro-3-nitrophenyl)-2H-tetrazole

AG003M5T

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CAS Number	328244-35-5
Catalog Number	AG003M5T(AGN-PC-0K2LAY)
Chemical Name	5-(4-Fluoro-3-nitrophenyl)-2H-tetrazole
IUPAC Name	5-(4-fluoro-3-nitrophenyl)-2H-tetrazole
InChI	InChI=1S/C7H4FN5O2/c8-5-2-1-4(3-6(5)13(14)15)7-9-11-12-10-7/h1-3H,(H,9,10,11,12)
InChI Key	YUJQZCDGMQSNKW-UHFFFAOYSA-N
MDL Number	MFCD18375293
Molecular Formula	C7H4FN5O2
Molecular Weight	209.1374
SMILES	[O-][N+](=O)C1=C(F)C=CC(=C1)C1=NNN=N1
Synonyms	5-(4-fluoro-3-nitrophenyl)-2H-tetrazole, 328244-35-5, 5-(4-fluoro-3-nitrophenyl)-1H-1,2,3,4-tetraazole, BAS 00771052, Oprea1_011170, Oprea1_188174, KS-00000E3P, 6263AJ, MFCD18375293, STK388418, ZINC33296079, AKOS000518934, AKOS027256931, MCULE-3774775574, TRA0031260, CS-11257, SY012453, 5-(4-fluoro-3-nitrophenyl)-1H-tetrazole, DB-068695, ST4038547, TC-307785, 5-(4-Fluoro-3-nitro-phenyl)-1H-tetrazole, EU-0003087, FT-0719266, MFCD18375293 (95%), SR-01000415180, SR-01000415180-1, A1791/0075868, 5-(4-FLUORO-3-NITROPHENYL)-2H-1,2,3,4-TETRAZOLE, C7H4FN5O2, CID1250491, 6223-78-5,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	209.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	209.14g/mol
Monoisotopic Mass	209.035g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	100A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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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