4-Cyanoacetylmorpholine - CAS 15029-32-0
Catalog: |
BB010515 |
Product Name: |
4-Cyanoacetylmorpholine |
CAS: |
15029-32-0 |
Synonyms: |
3-(4-morpholinyl)-3-oxopropanenitrile; 3-morpholin-4-yl-3-oxopropanenitrile |
IUPAC Name: | 3-morpholin-4-yl-3-oxopropanenitrile |
Description: | 4-Cyanoacetylmorpholine (CAS# 15029-32-0) is a useful research chemical compound. |
Molecular Weight: | 154.17 |
Molecular Formula: | C7H10N2O2 |
Canonical SMILES: | C1COCCN1C(=O)CC#N |
InChI: | InChI=1S/C7H10N2O2/c8-2-1-7(10)9-3-5-11-6-4-9/h1,3-6H2 |
InChI Key: | AUZPMUJGZZSMCP-UHFFFAOYSA-N |
Boiling Point: | 230.8 ℃ at 760 mmHg |
Density: | 1.173 g/cm3 |
Appearance: | Off-white crystalline powder |
MDL: | MFCD00023353 |
LogP: | -0.30322 |
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-2020249821-A1 | Novel arginase inhibitors | 20190614 |
KR-20210086680-A | Trifluoromethyl-substituted sulfonamides as BCL-2-selective inhibitors | 20181029 |
AU-2018369787-A1 | Immunoproteasome inhibitors | 20171116 |
CA-3080958-A1 | Immunoproteasome inhibitors | 20171116 |
WO-2019099576-A1 | Immunoproteasome inhibitors | 20171116 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.074227566 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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