AG0026Z2

17938-69-1 | Phenol, 4-iodo-2,3-dimethyl-

AG0026Z2

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CAS Number	17938-69-1
Catalog Number	AG0026Z2(AGN-PC-02KGFP)
Chemical Name	Phenol, 4-iodo-2,3-dimethyl-
IUPAC Name	4-iodo-2,3-dimethylphenol
InChI	InChI=1S/C8H9IO/c1-5-6(2)8(10)4-3-7(5)9/h3-4,10H,1-2H3
InChI Key	LLSRHWKZLHNAMI-UHFFFAOYSA-N
MDL Number	MFCD07779031
Molecular Formula	C8H9IO
Molecular Weight	248.0609
SMILES	OC1=CC=C(I)C(C)=C1C
Synonyms	4-Iodo-2,3-dimethylphenol, 17938-69-1, 2,3-DIMETHYL-4-IODOPHENOL, Phenol,4-iodo-2,3-dimethyl-, SCHEMBL15054663, CTK4D7261, Phenol, 4-iodo-2,3-dimethyl-, DTXSID10600237, CL9079, MFCD07779031, ZINC71255472, AKOS026732161, AS-46203, DB-082489, FT-0718179,

Complexity	116
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.97g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	248.063g/mol
Monoisotopic Mass	247.97g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	20.2A^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-H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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