AG009YDS

141998-92-7 | 5-Iodo-1-phenyl-1H-pyrazole

AG009YDS

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CAS Number	141998-92-7
Catalog Number	AG009YDS(AGN-PC-0035OY)
Chemical Name	5-Iodo-1-phenyl-1H-pyrazole
IUPAC Name	5-iodo-1-phenylpyrazole
InChI	InChI=1S/C9H7IN2/c10-9-6-7-11-12(9)8-4-2-1-3-5-8/h1-7H
InChI Key	IGQRKPVUDNAYDD-UHFFFAOYSA-N
MDL Number	MFCD27944668
Molecular Formula	C9H7IN2
Molecular Weight	270.0697
SMILES	n1ccc(n1c1ccccc1)I
Synonyms	5-Iodo-1-phenyl-1H-pyrazole, 141998-92-7, 1H-Pyrazole, 5-iodo-1-phenyl-, 5-IODO-1-PHENYLPYRAZOLE, SCHEMBL10280912, IGQRKPVUDNAYDD-UHFFFAOYSA-N, MFCD27944668, ZINC98178727, AKOS022188631, DS-9087, AK148803, AJ-139833, FT-0753265,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	269.965g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	270.073g/mol
Monoisotopic Mass	269.965g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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