AG00BXL7

368869-86-7 | 1-(4-Iodophenyl)-1H-pyrazole

AG00BXL7

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CAS Number	368869-86-7
Catalog Number	AG00BXL7(AGN-PC-0KKXKA)
Chemical Name	1-(4-Iodophenyl)-1H-pyrazole
IUPAC Name	1-(4-iodophenyl)pyrazole
InChI	InChI=1S/C9H7IN2/c10-8-2-4-9(5-3-8)12-7-1-6-11-12/h1-7H
InChI Key	ADIQBEMLKKKISJ-UHFFFAOYSA-N
MDL Number	MFCD02681941
Molecular Formula	C9H7IN2
Molecular Weight	270.0697
SMILES	IC1=CC=C(N2N=CC=C2)C=C1
Synonyms	1-(4-Iodophenyl)-1H-Pyrazole, 368869-86-7, 1-(4-iodophenyl)pyrazole, AK-84500, J-503326, (4-iodophenyl)pyrazole, AC1MCR05, AC1Q4P7R, SCHEMBL1507232, CTK4H7333, KS-00000LSY, DTXSID00380117, 1-(4-Iodo-phenyl)-1H-pyrazole, 1H-Pyrazole,1-(4-iodophenyl)-, ADIQBEMLKKKISJ-UHFFFAOYSA-N, ZINC158885, 1H-Pyrazole, 1-(4-iodophenyl)-, ZX-AT009454, ANW-63370, MFCD02681941, SBB054176, AKOS016003635, AC-9364, AN-7080, FCH1322086, OR23295, RP06480, ACM368869867, AJ-15387, DS-17443, SC-48838, ZB007119, AX8051183, DB-004471, RT-006083, ST2403212, 4CH-017751, FT-0605730, Y8885, A823433, I14-60558, C9H7IN2, ZINC00158885, CID2776481,

Complexity	144
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	2.9

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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