2-Chloro-3-hydroxy-2-cyclohexenone - CAS 89466-67-1
Catalog: |
BB039495 |
Product Name: |
2-Chloro-3-hydroxy-2-cyclohexenone |
CAS: |
89466-67-1 |
Synonyms: |
2-chloro-3-hydroxy-1-cyclohex-2-enone; 2-chloro-3-hydroxycyclohex-2-en-1-one |
IUPAC Name: | 2-chloro-3-hydroxycyclohex-2-en-1-one |
Description: | 2-Chloro-3-hydroxy-2-cyclohexenone (CAS# 89466-67-1 ) is a useful research chemical. |
Molecular Weight: | 146.57 |
Molecular Formula: | C6H7ClO2 |
Canonical SMILES: | C1CC(=C(C(=O)C1)Cl)O |
InChI: | InChI=1S/C6H7ClO2/c7-6-4(8)2-1-3-5(6)9/h8H,1-3H2 |
InChI Key: | ZJPMFCHLKVIZRG-UHFFFAOYSA-N |
Boiling Point: | 220.6 °C at 760 mmHg |
Density: | 1.35 g/cm3 |
LogP: | 1.74780 |
Publication Number | Title | Priority Date |
CA-2527691-A1 | Condensed ring compound | 20030530 |
CA-2527691-C | Condensed ring compound | 20030530 |
EP-1630152-A1 | Condensed ring compound | 20030530 |
JP-2005343792-A | Fused ring compounds | 20030530 |
JP-4805552-B2 | Fused ring compounds | 20030530 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.0134572 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.0134572 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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