AG0059GA

78597-27-0 | 6-Iodo-1H-benzo[d]imidazole

AG0059GA

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CAS Number	78597-27-0
Catalog Number	AG0059GA(AGN-PC-002EIO)
Chemical Name	6-Iodo-1H-benzo[d]imidazole
IUPAC Name	6-iodo-1H-benzimidazole
InChI	InChI=1S/C7H5IN2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,(H,9,10)
InChI Key	NQDPBRYGCUYBJM-UHFFFAOYSA-N
MDL Number	MFCD13185224
Molecular Formula	C7H5IN2
Molecular Weight	244.0325
SMILES	IC1=CC2=C(C=C1)N=CN2
Synonyms	6-Iodo-1H-benzo[d]imidazole, 78597-27-0, 5-iodo-1h-benzimidazole, 6-Iodobenzimidazole, 5-IODO-1H-BENZO[D]IMIDAZOLE, 6-iodo-1H-benzimidazole, AK-77092, 1H-Benzimidazole,6-iodo-, SCHEMBL4740274, CTK5E5949, KS-00000DCW, DTXSID70563556, NQDPBRYGCUYBJM-UHFFFAOYSA-N, ANW-71657, MFCD13185224, ZINC34355239, AKOS016007350, AKOS023169378, AB25990, CS-W006895, QC-5240, AC-28880, AJ-88122, DS-16972, SY033818, AB0069757, AX8104300, DB-075495, ST2412416, TC-160402, 4CH-016448, FT-0648052, MFCD13185224 (95%), 1H-Benzimidazole, 6-iodo-, ACN-054228,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.95g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	244.035g/mol
Monoisotopic Mass	243.95g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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