AG00BDQY

25245-27-6 | 1-Iodo-3,5-dimethoxybenzene

AG00BDQY

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CAS Number	25245-27-6
Catalog Number	AG00BDQY(AGN-PC-0JU752)
Chemical Name	1-Iodo-3,5-dimethoxybenzene
IUPAC Name	1-iodo-3,5-dimethoxybenzene
InChI	InChI=1S/C8H9IO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,1-2H3
InChI Key	MMOMUEFLZAHIAZ-UHFFFAOYSA-N
MDL Number	MFCD08729270
Molecular Formula	C8H9IO2
Molecular Weight	264.0603
SMILES	COC1=CC(OC)=CC(I)=C1
Synonyms	1-iodo-3,5-dimethoxybenzene, 25245-27-6, 1,3-Dimethoxy-5-iodobenzene, 3,5-Dimethoxyiodobenzene, benzene, 1-iodo-3,5-dimethoxy-, 1-Iodo-3,5-dimethoxy-benzene, Benzene,1-iodo-3,5-dimethoxy-, 3,5-Dimethoxyphenyl iodide, PubChem4400, PubChem19608, 3,5-Dimethoxy-1-iodobenzene, SCHEMBL388181, AC1LD045, CTK4F5296, KS-00000DCO, DTXSID10348703, MMOMUEFLZAHIAZ-UHFFFAOYSA-N, ACT00772, CS-D1784, ANW-70661, MFCD08729270, ZINC32299191, AKOS015890082, AC-9714, AM61866, AS01576, VZ21489, AJ-85200, AK-86785, AS-18234, CJ-17949, SC-04778, SY029324, AB0023725, DB-067358, TC-159406, FT-0651844, ST24021323, W4852, MFCD08729270 (95%), M-9288, I01-4742, InChI=1/C8H9IO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,1-2H, C8H9IO2, CID640179,

Complexity	107
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	2.5

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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