Ethyl 5-Bromo-2-chlorobenzoate - CAS 76008-73-6
Catalog: |
BB035474 |
Product Name: |
Ethyl 5-Bromo-2-chlorobenzoate |
CAS: |
76008-73-6 |
Synonyms: |
ethyl 5-bromo-2-chlorobenzoate |
IUPAC Name: | ethyl 5-bromo-2-chlorobenzoate |
Description: | Ethyl 5-Bromo-2-chlorobenzoate (CAS# 76008-73-6) is a useful research chemical. |
Molecular Weight: | 263.52 |
Molecular Formula: | C9H8BrClO2 |
Canonical SMILES: | CCOC(=O)C1=C(C=CC(=C1)Br)Cl |
InChI: | InChI=1S/C9H8BrClO2/c1-2-13-9(12)7-5-6(10)3-4-8(7)11/h3-5H,2H2,1H3 |
InChI Key: | AMGWDYLEMSMUIO-UHFFFAOYSA-N |
Boiling Point: | 288 °C (lit.) |
Melting Point: | 128-130 °C |
Purity: | 97.0 % (GC) |
Density: | 1.48 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00013635 |
LogP: | 3.27920 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112110827-A | Diamine, and preparation method and application thereof | 20200902 |
JP-2020098169-A | Heat treatment apparatus, heat treatment method, and article management system using the same | 20181219 |
JP-2020079761-A | Temperature indicator and article management system using the same | 20181114 |
JP-2020064017-A | Temperature sensing material, temperature sensing ink using the same, temperature indicator, and article management system | 20181019 |
WO-2020080313-A1 | Temperature detecting material, temperature detecting ink using same, temperature indicator, and article management system | 20181019 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.93962 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.93962 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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