4-Chlorophenoxyacetyl chloride - CAS 4122-68-3
Catalog: |
BB024821 |
Product Name: |
4-Chlorophenoxyacetyl chloride |
CAS: |
4122-68-3 |
Synonyms: |
2-(4-chlorophenoxy)acetyl chloride |
IUPAC Name: | 2-(4-chlorophenoxy)acetyl chloride |
Description: | 4-Chlorophenoxyacetyl chloride (CAS# 4122-68-3) is a useful research chemical. |
Molecular Weight: | 205.04 |
Molecular Formula: | C8H6Cl2O2 |
Canonical SMILES: | C1=CC(=CC=C1OCC(=O)Cl)Cl |
InChI: | InChI=1S/C8H6Cl2O2/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2 |
InChI Key: | VRBVHQUSAOKVDH-UHFFFAOYSA-N |
Boiling Point: | 142 °C (17 torr) |
Purity: | > 98.0 % (T) |
Density: | 1.314 g/cm3 |
MDL: | MFCD00000727 |
LogP: | 2.48420 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
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Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.9744848 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.9744848 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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