Ethyl 1-(Fluoromethyl)cyclopropanecarboxylate - CAS 917095-87-5
Catalog: |
BB040326 |
Product Name: |
Ethyl 1-(Fluoromethyl)cyclopropanecarboxylate |
CAS: |
917095-87-5 |
Synonyms: |
1-(fluoromethyl)-1-cyclopropanecarboxylic acid ethyl ester; ethyl 1-(fluoromethyl)cyclopropane-1-carboxylate |
IUPAC Name: | ethyl 1-(fluoromethyl)cyclopropane-1-carboxylate |
Description: | Ethyl 1-(Fluoromethyl)cyclopropanecarboxylate (CAS# 917095-87-5 ) is a useful research chemical. |
Molecular Weight: | 146.16 |
Molecular Formula: | C7H11FO2 |
Canonical SMILES: | CCOC(=O)C1(CC1)CF |
InChI: | InChI=1S/C7H11FO2/c1-2-10-6(9)7(5-8)3-4-7/h2-5H2,1H3 |
InChI Key: | VDOLMNJREJLNBA-UHFFFAOYSA-N |
MDL: | MFCD26727589 |
LogP: | 1.29920 |
Publication Number | Title | Priority Date |
US-2019382394-A1 | Inhibiting agents for bruton's tyrosine kinase | 20180514 |
WO-2019222101-A1 | Inhibiting agents for bruton's tyrosine kinase | 20180514 |
TW-202016097-A | Bruton's tyrosine kinase inhibitor | 20180514 |
EP-3793994-A1 | Inhibiting agents for bruton's tyrosine kinase | 20180514 |
US-10899753-B2 | Inhibiting agents for Bruton's tyrosine kinase | 20180514 |
Complexity: | 141 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.07430775 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.07430775 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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