Chloroacetaldehyde diethyl acetal - CAS 621-62-5
Catalog: |
BB031448 |
Product Name: |
Chloroacetaldehyde diethyl acetal |
CAS: |
621-62-5 |
Synonyms: |
2-chloro-1,1-diethoxyethane |
IUPAC Name: | 2-chloro-1,1-diethoxyethane |
Description: | Chloroacetaldehyde diethyl acetal (CAS# 621-62-5) is a reagent for the preparation of thiopene-anthranilamides which is a highly potent and orally available factor Xa inhibitor. |
Molecular Weight: | 152.62 |
Molecular Formula: | C6H13ClO2 |
Canonical SMILES: | CCOC(CCl)OCC |
InChI: | InChI=1S/C6H13ClO2/c1-3-8-6(5-7)9-4-2/h6H,3-5H2,1-2H3 |
InChI Key: | OVXJWSYBABKZMD-UHFFFAOYSA-N |
Boiling Point: | 157 ℃ |
Melting Point: | -45 ℃ |
Purity: | 95 % |
Density: | 1.018 g/cm3 |
Appearance: | Clear colourless to slightly yellowish liquid |
Storage: | Flammables area |
MDL: | MFCD00000949 |
LogP: | 1.62430 |
Vapor Pressure: | 5.0 [mmHg] |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113480441-A | Method for preparing aminoacetaldehyde dialkyl acetal | 20210615 |
JP-2021158315-A | Coupled polymers, solutions for forming organic semiconductor layers, organic semiconductor layers, and organic thin film transistors | 20200330 |
JP-2021155726-A | Pigment dispersion | 20200327 |
WO-2021103257-A1 | Continuous preparation method for 2-amino-pyrrole-3-carboxylate | 20191125 |
US-2021078996-A1 | Hpk1 antagonists and uses thereof | 20190913 |
PMID | Publication Date | Title | Journal |
14713150 | 20031101 | Lipophylic compounds from Euphorbia peplis L.--a halophytic plant from the Bulgarian Black Sea coast | Zeitschrift fur Naturforschung. C, Journal of biosciences |
Complexity: | 53 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0604073 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0604073 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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