2-Cyano-2-methylpropanamide - CAS 7505-93-3
Catalog: |
BB035231 |
Product Name: |
2-Cyano-2-methylpropanamide |
CAS: |
7505-93-3 |
Synonyms: |
2-cyano-2-methylpropanamide; 2-cyano-2-methylpropanamide |
IUPAC Name: | 2-cyano-2-methylpropanamide |
Description: | 2-Cyano-2-methylpropanamide (CAS# 7505-93-3) is a useful research chemical. |
Molecular Weight: | 112.13 |
Molecular Formula: | C5H8N2O |
Canonical SMILES: | CC(C)(C#N)C(=O)N |
InChI: | InChI=1S/C5H8N2O/c1-5(2,3-6)4(7)8/h1-2H3,(H2,7,8) |
InChI Key: | IQCHZCYHDCDSFI-UHFFFAOYSA-N |
Boiling Point: | 285.1 °C at 760 mmHg |
Density: | 1.064 g/cm3 |
LogP: | 0.72178 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021501179-A | Aminoimidazopyridazine as a kinase inhibitor | 20171030 |
JP-2020514377-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating IRE1-related diseases and disorders | 20170317 |
JP-6925435-B2 | Methods for treating pyrimidinyl-pyridyloxy-naphthyl compounds and IRE1-related diseases and disorders | 20170317 |
KR-20190072530-A | Ketone inhibitor of ricin zypine | 20160916 |
AU-2017311597-A1 | Fumagillol compounds and methods of making and using same | 20160811 |
PMID | Publication Date | Title | Journal |
22606182 | 20120401 | 2-Cyano-2-methyl-propanamide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 112.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 112.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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