Ethyl 1-(Hydroxymethyl)cyclopropanecarboxylate - CAS 3697-68-5
Catalog: |
BB023160 |
Product Name: |
Ethyl 1-(Hydroxymethyl)cyclopropanecarboxylate |
CAS: |
3697-68-5 |
Synonyms: |
1-(hydroxymethyl)-1-cyclopropanecarboxylic acid ethyl ester; ethyl 1-(hydroxymethyl)cyclopropane-1-carboxylate |
IUPAC Name: | ethyl 1-(hydroxymethyl)cyclopropane-1-carboxylate |
Description: | Ethyl 1-(Hydroxymethyl)cyclopropanecarboxylate (CAS# 3697-68-5) is a reagent used in the preparation of insecticides based on N-(6-arylpyridazin-3-yl)amide compounds. |
Molecular Weight: | 144.17 |
Molecular Formula: | C7H12O3 |
Canonical SMILES: | CCOC(=O)C1(CC1)CO |
InChI: | InChI=1S/C7H12O3/c1-2-10-6(9)7(5-8)3-4-7/h8H,2-5H2,1H3 |
InChI Key: | PAILVKQSHRJIPE-UHFFFAOYSA-N |
Appearance: | Colorless viscous liquid |
MDL: | MFCD09759206 |
LogP: | 0.32200 |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021018237-A1 | Dihydropyrimidine derivatives and uses thereof in the treatment of hbv infection or of hbv-induced diseases | 20190731 |
US-2020079772-A1 | Antiviral pyridopyrazinedione compounds | 20180912 |
WO-2020053654-A1 | Antiviral pyridopyrazinedione compounds | 20180912 |
CN-112996789-A | Antiviral pyridopyrazinedione compounds | 20180912 |
EP-3849979-A1 | Antiviral pyridopyrazinedione compounds | 20180912 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.078644241 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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