AG00C7GH

365526-34-7 | Methyl 4-chloro-3-iodobenzoate

AG00C7GH

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CAS Number	365526-34-7
Catalog Number	AG00C7GH(AGN-PC-00PJGY)
Chemical Name	Methyl 4-chloro-3-iodobenzoate
IUPAC Name	methyl 4-chloro-3-iodobenzoate
InChI	InChI=1S/C8H6ClIO2/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4H,1H3
InChI Key	LWENYAHUBUWONE-UHFFFAOYSA-N
MDL Number	MFCD09263357
Molecular Formula	C8H6ClIO2
Molecular Weight	296.4895
SMILES	C(=O)(OC)c1cc(I)c(cc1)Cl
Synonyms	Methyl 4-chloro-3-iodobenzoate, 365526-34-7, Methyl 3-Iodo-4-chlorobenzoate, 4-chloro-3-iodo-benzoic acid methyl ester, Benzoic acid, 4-chloro-3-iodo-, methyl ester, SCHEMBL2196660, CTK8I4324, Methyl 4-chloro-3-iodo-benzoate, LWENYAHUBUWONE-UHFFFAOYSA-N, MFCD09263357, ZINC21304461, AKOS015890697, KA-5035, MCULE-2423835047, KS-0000279G, 3-Iodo-4-chlorobenzoic acid methyl ester, DB-069400, FT-0729395, TL80074028, Z-8037, I01-8041, 5-Bromo-Benzooxazole, 5-bromobenzo[d]oxazole, Methyl4-Chloro-3-Iodobenzoate, A2788, 132244-31-6,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	295.91g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	296.488g/mol
Monoisotopic Mass	295.91g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number