AG00FAFS

71759-88-1 | 5-Iodo-1-methyl-1H-imidazole

AG00FAFS

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CAS Number	71759-88-1
Catalog Number	AG00FAFS(AGN-PC-0K2YTX)
Chemical Name	5-Iodo-1-methyl-1H-imidazole
IUPAC Name	5-iodo-1-methylimidazole
InChI	InChI=1S/C4H5IN2/c1-7-3-6-2-4(7)5/h2-3H,1H3
InChI Key	DPUVICGLBCCTDM-UHFFFAOYSA-N
MDL Number	MFCD01632215
Molecular Formula	C4H5IN2
Molecular Weight	208.0004
SMILES	CN1C(I)=CN=C1
Synonyms	5-Iodo-1-methyl-1H-imidazole, 71759-88-1, 5-Iodo-1-methylimidazole, 1H-Imidazole, 5-iodo-1-methyl-, MFCD01632215, PubChem8949, AC1LP0ON, ACMC-209ok2, 5-iodo-1-methyl-imidazole, 5 - Iodo-1-methylimidazole, 5-iodanyl-1-methyl-imidazole, KSC498C1H, SCHEMBL730978, 1-Methyl-5-iodo-1H-imidazole, CTK3J8113, DPUVICGLBCCTDM-UHFFFAOYSA-, KS-00000JPU, 1H-Imidazole,5-iodo-1-methyl-, DTXSID00361582, 5-Iodo-1-methylimidazole, 97%, DPUVICGLBCCTDM-UHFFFAOYSA-N, ACN-P000953, ZINC1095289, ANW-36096, CI-525, AKOS015850843, CS-W006750, PB12244, PS-3337, RTC-069024, VI10182, AC-26470, AJ-25037, AK-36203, AM804273, BR-36203, CJ-04775, SC-93188, ZB016024, AB0026410, DB-055568, I2147M500, TC-069024, TL8005029, 4CH-011609, FT-0641365, ST24024115, W8067, B-4532, 759I881, A837317, InChI=1/C4H5IN2/c1-7-3-6-2-4(7)5/h2-3H,1H3, C4H5IN2, ZINC01095289, CID1277668,

Complexity	66.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.95g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.002g/mol
Monoisotopic Mass	207.95g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H317-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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