1-(4-Piperidyl)ethanone - CAS 30818-11-2
Catalog: |
BB020735 |
Product Name: |
1-(4-Piperidyl)ethanone |
CAS: |
30818-11-2 |
Synonyms: |
1-(4-piperidinyl)ethanone; 1-piperidin-4-ylethanone |
IUPAC Name: | 1-piperidin-4-ylethanone |
Description: | 1-(4-Piperidyl)ethanone (CAS# 30818-11-2) is a useful research chemical. |
Molecular Weight: | 127.18 |
Molecular Formula: | C7H13NO |
Canonical SMILES: | CC(=O)C1CCNCC1 |
InChI: | InChI=1S/C7H13NO/c1-6(9)7-2-4-8-5-3-7/h7-8H,2-5H2,1H3 |
InChI Key: | STNLQJRBZHAGSO-UHFFFAOYSA-N |
Boiling Point: | 201.6 °C at 760 mmHg |
Density: | 0.95 g/cm3 |
LogP: | 0.90380 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021071821-A1 | Arylmethylene aromatic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
WO-2021062246-A1 | Crf receptor antagonists and methods of use | 20190927 |
WO-2020112581-A1 | Novel substituted piperazine amide compounds as indoleamine 2, 3-dioxygenase (ido) inhibitors | 20181128 |
US-2021204545-A1 | Benzimidazole compound or salt thereof, agricultural and horticultural insecticidal and acaricidal agent containing said compound, and method for using same | 20180522 |
TW-202015674-A | Triazolopyrimidine compound and its use in treating cancer | 20180511 |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.099714038 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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