AG00ECY3

62415-74-1 | 3,4-Dibromoanisole

AG00ECY3

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CAS Number	62415-74-1
Catalog Number	AG00ECY3(AGN-PC-00867H)
Chemical Name	3,4-Dibromoanisole
EC Number	613-029-4
IUPAC Name	1,2-dibromo-4-methoxybenzene
InChI	InChI=1S/C7H6Br2O/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
InChI Key	NTZLWIFNHUJNJS-UHFFFAOYSA-N
MDL Number	MFCD00070786
Molecular Formula	C7H6Br2O
Molecular Weight	265.9299
SMILES	COC1=CC(Br)=C(Br)C=C1
Synonyms	3,4-Dibromoanisole, 62415-74-1, 1,2-Dibromo-4-methoxybenzene, 1,2-dibromo-4-methoxy-benzene, PubChem4110, ACMC-209n3e, SCHEMBL1134723, CTK5B5065, DTXSID30464479, KS-00000HU5, ZINC2545246, 1,?2-?Dibromo-?4-?methoxybenzene, ANW-34200, MFCD00070786, AKOS010001501, AS03504, AS04211, CM11710, AJ-39270, AK-86954, AS-18024, BC002717, BC676631, SC-82736, AB0068522, TC-122945, FT-0712225, V6948, A-2754, A19920, I01-9253, 3,4-Dibromoanisole 94%, remainder predominantly isomer, C7H6Br2O, 4-methoxybenzene-1,2-diamine, CID11391461, 102-51-2,

Complexity	108
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.876g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	265.932g/mol
Monoisotopic Mass	263.879g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335-H413
Precuationary statements	P261-P273-P305+P351+P338
Siginal words

Certificate of Analysis

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