AG00DBPQ

5460-32-2 | 3,4-DIMETHOXYIODOBENZENE

AG00DBPQ

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CAS Number	5460-32-2
Catalog Number	AG00DBPQ(AGN-PC-0JO8OS)
Chemical Name	3,4-DIMETHOXYIODOBENZENE
IUPAC Name	4-iodo-1,2-dimethoxybenzene
InChI	InChI=1S/C8H9IO2/c1-10-7-4-3-6(9)5-8(7)11-2/h3-5H,1-2H3
InChI Key	PUCISUQLWLKKJH-UHFFFAOYSA-N
MDL Number	MFCD00094416
Molecular Formula	C8H9IO2
Molecular Weight	264.0603
NSC Number	25012
SMILES	O(C)c1c(OC)cc(cc1)I
Synonyms	4-Iodo-1,2-dimethoxybenzene, 5460-32-2, 3,4-Dimethoxyiodobenzene, 1,2-dimethoxy-4-iodobenzene, 4-Iodo-1,2-dimethoxy-benzene, PUCISUQLWLKKJH-UHFFFAOYSA-N, 4-iodoveratrole, 4-iodoveratrol, NSC25012, PubChem3052, AC1Q4PHA, 3,4-dimethoxyphenyl iodide, AC1L5J8I, SCHEMBL470124, 4-Iodo-1,2-dimethoxybenzene #, Benzene,4-iodo-1,2-dimethoxy-, CTK5A1860, DTXSID10282219, Benzene, 4-iodo-1,2-dimethoxy-, ZINC1512912, 7908AB, ANW-73085, BBL034724, MFCD00094416, NSC-25012, STL420395, AKOS015917619, AS02534, CS-W022198, MCULE-3006163801, AC-20921, AJ-26492, AK109048, AS-10563, CJ-23795, AB0067773, ST2405837, TC-161830, FT-0656940, S01-0419, C8H9IO2, AR-1G2903, CID230307, 3,4-Dimethoxyiodobenzene, 95% - 25G 25g, 6318-89-4,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.965g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	264.062g/mol
Monoisotopic Mass	263.965g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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