AG0014JS

13329-40-3 | Ethanone, 1-​(4-​iodophenyl)​-

AG0014JS

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CAS Number	13329-40-3
Catalog Number	AG0014JS(AGN-PC-00BOYY)
Chemical Name	Ethanone, 1-​(4-​iodophenyl)​-
EC Number	236-372-8
IUPAC Name	1-(4-iodophenyl)ethanone
InChI	InChI=1S/C8H7IO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
InChI Key	JZJWCDQGIPQBAO-UHFFFAOYSA-N
MDL Number	MFCD00045320
Molecular Formula	C8H7IO
Molecular Weight	246.0451
NSC Number	97396
SMILES	C(=O)(C)c1ccc(cc1)I
Synonyms	4'-Iodoacetophenone, 13329-40-3, 1-(4-Iodophenyl)ethanone, 4-Iodoacetophenone, 1-(4-Iodophenyl)ethan-1-one, p-Iodoacetophenone, Ethanone, 1-(4-iodophenyl)-, MFCD00045320, 1-(4-iodo-phenyl)-ethanone, JZJWCDQGIPQBAO-UHFFFAOYSA-N, 1-acetyl-4-iodobenzene, 4'-Iodoacetophenone, 98%, NSC97396, 4-iodo acetophenone, EINECS 236-372-8, 4;-Iodoacetophenone, 4'-iodo acetophenone, PubChem3323, 4\'-Iodoacetophenone, ACMC-209brs, AC1L2IUH, AC1Q1JQN, 4-iodophenyl methyl ketone, Intermediates-ZCF02033, 1-(4-iodophenyl)-ethanone, KSC490E0D, 1-(4-Iodophenyl)ethanone #, SCHEMBL457196, 1-(4-iodophenyl)-1-ethanone, 4'-Iodoacetophenone, >=97%, 1-(4-Iodophenyl)-1-oxoethane, CTK3J0201, DTXSID70158047, WT169, ZINC160546, ACT08155, BCP22400, KS-00000C2J, ANW-19526, BBL000081, NSC-97396, SBB058956, STK071379, 13329-40-3 4'-iodoacetophenone, AKOS000120603, AC-3622, AS04012, CM11220, MCULE-3852519586, PS-5958, RP28726, RS-1025, RTR-004536, TRA0090169, VZ29247, AJ-15603, AK-42208, AN-12823, BR-42208, CJ-01928, Q678, SC-00833, SY011859, ZB007384, AB0005015, DB-015502, TR-004536, 4 inverted exclamation mark -Iodoacetophenone, AM20020405, FT-0618775, I0305, ST24026913, ST51036730, MFCD00045320 (98%), A19685, C-4694, I01-3115, J-515569, W-108299, Z57073725, F2182-0145, InChI=1/C8H7IO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H, C8H7IO, 4-iodobenzeneacetaldehyde, 1-(4-Jodphenyl)-ethanon, 1-(4-Jodphenyl)ethan-1-on, C8-H7-I-O, CID72869, 4'-Iodoacetophenone, 98% - 100G 100g, (6R,7R)-7-Amino-8-oxo-3-(1-propenyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 120709-09-3,

Complexity	125
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.954g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	246.047g/mol
Monoisotopic Mass	245.954g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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