5-Bromo-1,2,3-trimethoxybenzene - CAS 2675-79-8
Catalog: |
BB019355 |
Product Name: |
5-Bromo-1,2,3-trimethoxybenzene |
CAS: |
2675-79-8 |
Synonyms: |
5-bromo-1,2,3-trimethoxybenzene |
IUPAC Name: | 5-bromo-1,2,3-trimethoxybenzene |
Description: | 5-Bromo-1,2,3-trimethoxybenzene (CAS# 2675-79-8) is a useful research chemical. |
Molecular Weight: | 247.09 |
Molecular Formula: | C9H11BrO3 |
Canonical SMILES: | COC1=CC(=CC(=C1OC)OC)Br |
InChI: | InChI=1S/C9H11BrO3/c1-11-7-4-6(10)5-8(12-2)9(7)13-3/h4-5H,1-3H3 |
InChI Key: | XAOOZMATJDXDQJ-UHFFFAOYSA-N |
Boiling Point: | 262.2 °C at 760 mmHg |
Melting Point: | 78-82 °C |
Purity: | 95 % |
Density: | 1.391 g/cm3 |
Appearance: | Off-white crystals |
MDL: | MFCD00017169 |
LogP: | 2.47490 |
GHS Hazard Statement: | H315 (13.64%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113372201-A | Preparation method of biphenol compound and derivatives thereof | 20210610 |
CN-111620768-A | Method for synthesizing aryl ketone compound by using AQ as photocatalyst | 20200616 |
EP-3892602-A1 | Method for the preparation of deuterated or tritiated compounds | 20200408 |
KR-20210106381-A | A novel synthetic method of organoselenum compounds | 20200220 |
KR-20210076875-A | Compound for inhibiting neovascularization factor and use thereof | 20191216 |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.98916 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.98916 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 27.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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