1-Ethylpiperidine-4-carboxylic Acid - CAS 90204-94-7
Catalog: |
BB039781 |
Product Name: |
1-Ethylpiperidine-4-carboxylic Acid |
CAS: |
90204-94-7 |
Synonyms: |
1-ethyl-4-piperidinecarboxylic acid; 1-ethylpiperidine-4-carboxylic acid |
IUPAC Name: | 1-ethylpiperidine-4-carboxylic acid |
Description: | 1-Ethylpiperidine-4-carboxylic Acid (CAS# 90204-94-7) is an intermediate in the synthesis of PARP-1 inhibitors, involved in DNA repair, and RNA transcription modulation. |
Molecular Weight: | 157.21 |
Molecular Formula: | C8H15NO2 |
Canonical SMILES: | CCN1CCC(CC1)C(=O)O |
InChI: | InChI=1S/C8H15NO2/c1-2-9-5-3-7(4-6-9)8(10)11/h7H,2-6H2,1H3,(H,10,11) |
InChI Key: | IDHMTYNXPJWISA-UHFFFAOYSA-N |
Boiling Point: | 262.665 ℃ at 760 mmHg |
Density: | 1.067 g/cm3 |
LogP: | 0.74080 |
Publication Number | Title | Priority Date |
US-2021130325-A1 | Heteroaryl-biphenyl amides for the treatment of pd-l1 diseases | 20191016 |
WO-2021065980-A1 | Bet degrader | 20190930 |
WO-2021021000-A1 | Method for producing avatrombopag | 20190801 |
WO-2021000041-A1 | Ionizable lipids for nucleic acid delivery | 20190629 |
WO-2020252589-A1 | Ionizable lipids for nucleic acid delivery | 20190620 |
Complexity: | 139 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.110278721 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.6 |
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