AG0038MF

573764-31-5 | 4-Chloro-3-Iodoaniline

AG0038MF

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CAS Number	573764-31-5
Catalog Number	AG0038MF(AGN-PC-03H18R)
Chemical Name	4-Chloro-3-Iodoaniline
IUPAC Name	4-chloro-3-iodoaniline
InChI	InChI=1S/C6H5ClIN/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2
InChI Key	AWJWTZAGRWNBFC-UHFFFAOYSA-N
MDL Number	MFCD11521292
Molecular Formula	C6H5ClIN
Molecular Weight	253.4681
SMILES	ClC1=C(C=C(N)C=C1)I
Synonyms	4-chloro-3-iodoaniline, 573764-31-5, Benzenamine, 4-chloro-3-iodo-, 3-iodo-4-chloroaniline, 4-Chloro-3-iodo-aniline, 4-chloro-3-iodo aniline, 4-chloro-3-iodophenylamine, 4-Chloro-3-iodo-phenylamine, 4-chloranyl-3-iodanyl-aniline, SCHEMBL1016688, CTK1G8995, KS-00000IFM, DTXSID50619242, AWJWTZAGRWNBFC-UHFFFAOYSA-N, 6136AJ, MFCD11521292, TD1336, ZINC71618592, AKOS022171757, CC-1710, CS-W005554, EBD2210855, MB09944, PS-7437, AC-28496, AK132972, SC-89648, SY034476, AB0088394, AJ-118313, 4CH-000286, FT-0728379, ST24043581, MFCD11521292 (95%), W-4420, A831416, AE-562/43458279, J-504517, Z2379087697, C6H5ClIN, 1-Chloro-4-methyl-2-nitrobenzene, ACN-042393,

Complexity	99.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	252.916g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	253.467g/mol
Monoisotopic Mass	252.916g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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