1,3,5-Tribromo-2-methoxy-4-methylbenzene - CAS 41424-36-6
Catalog: |
BB024881 |
Product Name: |
1,3,5-Tribromo-2-methoxy-4-methylbenzene |
CAS: |
41424-36-6 |
Synonyms: |
1,3,5-tribromo-2-methoxy-4-methylbenzene |
IUPAC Name: | 1,3,5-tribromo-2-methoxy-4-methylbenzene |
Description: | 1,3,5-Tribromo-2-methoxy-4-methylbenzene (CAS# 41424-36-6) is a compound useful in organic synthesis. |
Molecular Weight: | 358.85 |
Molecular Formula: | C8H7Br3O |
Canonical SMILES: | CC1=C(C(=C(C=C1Br)Br)OC)Br |
InChI: | InChI=1S/C8H7Br3O/c1-4-5(9)3-6(10)8(12-2)7(4)11/h3H,1-2H3 |
InChI Key: | NMPPAMFEYWGNCI-UHFFFAOYSA-N |
Boiling Point: | 308-311 °C / 748 mmHg (lit.) |
Density: | 2.013 g/cm3 |
LogP: | 4.29110 |
Publication Number | Title | Priority Date |
CA-1330539-C | Fragrance compositions containing 2,4,6-tribromo-3- methylanisole | 19871021 |
EP-0312882-A2 | Fragrance compositions containing a halogenated anisole derivative | 19871021 |
EP-0312882-B1 | Fragrance compositions containing a halogenated anisole derivative | 19871021 |
ES-2042683-T3 | AROMATIC COMPOSITIONS CONTAINING A DERIVATIVE OF HALOGENATED ANISOL. | 19871021 |
JP-H01141990-A | Fragrance composition | 19871021 |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 357.80265 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 355.8047 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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