AG003B7F

42048-11-3 | 1-Chloro-3-iodo-2-methylbenzene

AG003B7F

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CAS Number	42048-11-3
Catalog Number	AG003B7F(AGN-PC-0KKLWF)
Chemical Name	1-Chloro-3-iodo-2-methylbenzene
IUPAC Name	1-chloro-3-iodo-2-methylbenzene
InChI	InChI=1S/C7H6ClI/c1-5-6(8)3-2-4-7(5)9/h2-4H,1H3
InChI Key	OEHHXVIJMCMYGM-UHFFFAOYSA-N
MDL Number	MFCD00087376
Molecular Formula	C7H6ClI
Molecular Weight	252.4800
SMILES	CC1=C(Cl)C=CC=C1I
Synonyms	2-Chloro-6-iodotoluene, 42048-11-3, 1-chloro-3-iodo-2-methylbenzene, 6-chloro-2-iodotoluene, MFCD00019013, 1-chloro-3-iodo-2-methyl-benzene, PubChem3654, 2-Iodo-6-chlorotoluene, AC1MBWA4, AC1Q2FID, ACMC-1ARU0, SCHEMBL78766, KSC491K9P, CTK3J1597, 3-chloro-1-iodo-2-methylbenzene, DTXSID10373974, OEHHXVIJMCMYGM-UHFFFAOYSA-N, ZINC396910, ACT13371, BUTTPARK 121\11-22, KS-00000MZ6, 3-CHLORO-2-METHYLIODOBENZENE, ANW-29725, SBB101150, AKOS009158495, Benzene, 1-chloro-3-iodo-2-methyl-, AC-7433, AM61968, AN-6120, AS01025, CM13945, PS-7453, RTR-016521, TRA0074457, 1-IODO-2-METHYL-3-CHLOROBENZENE, AJ-21641, AK-35115, ZB012695, AB0031438, DB-020886, ST2416774, TR-016521, C1603, FT-0611869, X4530, 1-Chloro-3-iodo-2-methylbenzene, AldrichCPR, A19634, C-4639, I01-4836, Z1741963025, C7H6ClI, CID2757617, 2-Chloro-6-iodotoluene, 99% - 1G 1g,

Complexity	94.9
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.92g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	252.479g/mol
Monoisotopic Mass	251.92g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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