1-(2-Hydroxyethyl)pyrrolidine - CAS 2955-88-6
Catalog: |
BB020239 |
Product Name: |
1-(2-Hydroxyethyl)pyrrolidine |
CAS: |
2955-88-6 |
Synonyms: |
2-pyrrolidin-1-ylethanol |
IUPAC Name: | 2-pyrrolidin-1-ylethanol |
Description: | 1-(2-Hydroxyethyl)pyrrolidine (CAS# 2955-88-6) is a very useful synthetic intermediate. It is a reagent used to synthesize Diclofenac Epolamine (D436470) which is a diclofenac salt with greater water solubility and better cutaneous absorption properties than other commonly used forms of the drug. |
Molecular Weight: | 115.17 |
Molecular Formula: | C6H13NO |
Canonical SMILES: | C1CCN(C1)CCO |
InChI: | InChI=1S/C6H13NO/c8-6-5-7-3-1-2-4-7/h8H,1-6H2 |
InChI Key: | XBRDBODLCHKXHI-UHFFFAOYSA-N |
Boiling Point: | 79-81 °C (13 mmHg) |
Purity: | 98 % |
Density: | 0.985 g/cm3 |
Appearance: | Clear slightly yellow to brown liquid |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Flammables-area. |
MDL: | MFCD00003181 |
LogP: | 0.01240 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22336852 | 20120215 | Diclofenac with or without an antiemetic for acute migraine headaches in adults | The Cochrane database of systematic reviews |
22035444 | 20120101 | Therapeutic efficacy and tolerability of the topical treatment of inflammatory conditions of the oral cavity with a mouthwash containing diclofenac epolamine: a randomized, investigator-blind, parallel-group, controlled, phase III study | Clinical drug investigation |
22078067 | 20111112 | Blockade of leukocyte haptokinesis and haptotaxis by ketoprofen, diclofenac and SC-560 | BMC immunology |
21559350 | 20110307 | Diclofenac epolamine topical patch relieves pain associated with ankle sprain | Journal of pain research |
21378482 | 20110201 | Effectiveness and safety of diclofenac epolamine topical patch 1.3% for the treatment of acute pain due to back strain: an open-label, uncontrolled study | The Physician and sportsmedicine |
Complexity: | 59.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 115.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 115.099714038 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 23.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Pyrrolidines
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