AG000MC8

1245648-93-4 | Benzonitrile, 2-bromo-6-iodo-

AG000MC8

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CAS Number	1245648-93-4
Catalog Number	AG000MC8(AGN-PC-080FIP)
Chemical Name	Benzonitrile, 2-bromo-6-iodo-
IUPAC Name	2-bromo-6-iodobenzonitrile
InChI	InChI=1S/C7H3BrIN/c8-6-2-1-3-7(9)5(6)4-10/h1-3H
InChI Key	LXIBANSYVFWOAR-UHFFFAOYSA-N
MDL Number	MFCD16619725
Molecular Formula	C7H3BrIN
Molecular Weight	307.9139
SMILES	N#CC1=C(I)C=CC=C1Br
Synonyms	2-Bromo-6-iodobenzonitrile, 1245648-93-4, MFCD16619725, AK-76559, KSC493I4H, Benzonitrile, 2-bromo-6-iodo-, SCHEMBL17541429, CTK3J3443, DTXSID90677407, KS-00000HS3, ANW-49197, CL8155, ZINC66325511, AKOS015890471, AM84102, DS-1308, FCH1346027, BR-76559, CJ-21277, OR400749, AB0035291, AJ-115990, AX8160626, DB-010978, RT-001476, ST2409718, 4CH-008621, CS-0035102, X9595, J3.540.827D, S-5504, I01-6657, C7H3BrIN,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	306.849g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	307.916g/mol
Monoisotopic Mass	306.849g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	23.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number