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17715-69-4 | Benzene, 1-bromo-2,4-dimethoxy-
CAS No: 17715-69-4 Catalog No: AG00254C MDL No:MFCD00009844
Product Description
Catalog Number:
AG00254C
Chemical Name:
Benzene, 1-bromo-2,4-dimethoxy-
CAS Number:
17715-69-4
Molecular Formula:
C8H9BrO2
Molecular Weight:
217.0599
MDL Number:
MFCD00009844
IUPAC Name:
1-bromo-2,4-dimethoxybenzene
InChI:
InChI=1S/C8H9BrO2/c1-10-6-3-4-7(9)8(5-6)11-2/h3-5H,1-2H3
InChI Key:
NIUZVSQOXJIHBL-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC)Br
EC Number:
241-717-0
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.062g/mol
Monoisotopic Mass:
215.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Bis(2,4-dimeth-oxy-phen-yl)(phen-yl)phosphine selenide. | Acta crystallographica. Section E, Structure reports online 20110101 |
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