2-(3,4-Dichlorophenyl)ethanol - CAS 35364-79-5
Catalog: |
BB022622 |
Product Name: |
2-(3,4-Dichlorophenyl)ethanol |
CAS: |
35364-79-5 |
Synonyms: |
2-(3,4-dichlorophenyl)ethanol; 2-(3,4-dichlorophenyl)ethanol |
IUPAC Name: | 2-(3,4-dichlorophenyl)ethanol |
Description: | Intermediate in the synthesis of σ receptor ligands. |
Molecular Weight: | 191.05 |
Molecular Formula: | C8H8Cl2O |
Canonical SMILES: | C1=CC(=C(C=C1CCO)Cl)Cl |
InChI: | InChI=1S/C8H8Cl2O/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5,11H,3-4H2 |
InChI Key: | GITOMJDYNUMCOV-UHFFFAOYSA-N |
Boiling Point: | 279.1 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.329 g/cm3 |
Appearance: | Colorless liquid. |
MDL: | MFCD00800673 |
LogP: | 2.52820 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111848412-A | Method for efficiently realizing N-alkylation reaction by using cycloiridium catalyst | 20200807 |
KR-20200022710-A | Novel pyrrolidine or piperidine derivatives having activity for T-type calcium channel | 20180823 |
KR-102183666-B1 | Novel pyrrolidine or piperidine derivatives having activity for T-type calcium channel | 20180823 |
CN-109384645-B | Method for synthesizing secondary alcohol | 20170811 |
US-2019031624-A1 | Therapeutic compounds and methods to treat infection | 20170728 |
Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.9952203 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.9952203 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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