2-Chloroethyl Benzoate - CAS 939-55-9
Catalog: |
BB041139 |
Product Name: |
2-Chloroethyl Benzoate |
CAS: |
939-55-9 |
Synonyms: |
benzoic acid 2-chloroethyl ester; 2-chloroethyl benzoate |
IUPAC Name: | 2-chloroethyl benzoate |
Description: | 2-Chloroethyl Benzoate (CAS# 939-55-9) is a useful research chemical. |
Molecular Weight: | 184.62 |
Molecular Formula: | C9H9ClO2 |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)OCCCl |
InChI: | InChI=1S/C9H9ClO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2 |
InChI Key: | ANPPGQUFDXLAGY-UHFFFAOYSA-N |
Boiling Point: | 264.8 ℃ at 760 mmHg |
Density: | 1.189 g/cm3 |
MDL: | MFCD00045290 |
LogP: | 2.08220 |
Publication Number | Title | Priority Date |
CN-109021246-A | A kind of temperature-responsive metal organic frame nanocrystal and preparation method and application | 20180817 |
CN-109694423-B | Catalyst component for ethylene polymerization, preparation method thereof and catalyst for ethylene polymerization | 20171024 |
US-2020064334-A1 | Dock Derived Compound against Laminin Receptor (37 LR) and Uses thereof | 20170829 |
US-11022604-B2 | Dock derived compound against laminin receptor (37 LR) and uses thereof | 20170829 |
CN-105377847-A | Kinase inhibitors | 20130606 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.0291072 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.0291072 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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