AG00D9TM

4897-68-1 | 4-Bromo-3-iodoanisole

AG00D9TM

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CAS Number	4897-68-1
Catalog Number	AG00D9TM(AGN-PC-00J3XG)
Chemical Name	4-Bromo-3-iodoanisole
IUPAC Name	1-bromo-2-iodo-4-methoxybenzene
InChI	InChI=1S/C7H6BrIO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key	IGPSHEKLLKFEOJ-UHFFFAOYSA-N
MDL Number	MFCD00070743
Molecular Formula	C7H6BrIO
Molecular Weight	312.9304
SMILES	O(C)c1cc(I)c(cc1)Br
Synonyms	4-Bromo-3-iodoanisole, 4897-68-1, 1-bromo-2-iodo-4-methoxybenzene, 1-bromo-2-iodo-4-methoxy-benzene, Benzene, 1-bromo-2-iodo-4-methoxy-, AK110455, PubChem5347, 2-Iodo-4-methoxybromobenzene, SCHEMBL2803033, CTK1D5499, KS-00000NZQ, DTXSID70475069, IGPSHEKLLKFEOJ-UHFFFAOYSA-N, 1-bromo-2-iodo-4-methoxy benzene, ZINC2545220, ZX-AT005223, 6659AB, ANW-74854, MFCD00070743, AKOS016008478, ACM4897681, AS03357, AS04243, CM11651, DS-4619, FCH1329739, OR40681, 1-bromanyl-2-iodanyl-4-methoxy-benzene, AJ-39252, BC002953, SC-04790, AB0068113, AX8095037, DB-027530, TC-163599, CS-0031439, FT-0713905, A827636, C-53402, C7H6BrIO, CID11977104,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	311.865g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	312.932g/mol
Monoisotopic Mass	311.865g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number