2,4-Dicyano-3-methylglutaramide - CAS 5447-66-5
Catalog: |
BB028691 |
Product Name: |
2,4-Dicyano-3-methylglutaramide |
CAS: |
5447-66-5 |
Synonyms: |
2,4-dicyano-3-methylpentanediamide |
IUPAC Name: | 2,4-dicyano-3-methylpentanediamide |
Description: | 2,4-Dicyano-3-methylglutaramide (CAS# 5447-66-5 ) is a useful research chemical. |
Molecular Weight: | 194.19 |
Molecular Formula: | C8H10N4O2 |
Canonical SMILES: | CC(C(C#N)C(=O)N)C(C#N)C(=O)N |
InChI: | InChI=1S/C8H10N4O2/c1-4(5(2-9)7(11)13)6(3-10)8(12)14/h4-6H,1H3,(H2,11,13)(H2,12,14) |
InChI Key: | XLQBCZSOEGHLAA-UHFFFAOYSA-N |
Boiling Point: | 574 ℃ at 760 mmHg |
Density: | 1.293 g/cm3 |
MDL: | MFCD00008014 |
LogP: | 0.27326 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
KR-20170056699-A | Lithium secondary battery | 20141022 |
CA-2785949-A1 | Polyamine and method for producing thereof | 20100104 |
EP-2522688-A1 | Polyamine and method for producing the same | 20100104 |
US-2013123542-A1 | Polyamine and method for producing thereof | 20100104 |
US-2015133628-A1 | Polyamine and method for producing thereof | 20100104 |
Complexity: | 311 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.08037557 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.08037557 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 134 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.3 |
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