Diethyl malonimidate dihydrochloride - CAS 10344-69-1
Catalog: |
BB001135 |
Product Name: |
Diethyl malonimidate dihydrochloride |
CAS: |
10344-69-1 |
Synonyms: |
diethyl propanediimidate;dihydrochloride |
IUPAC Name: | diethyl propanediimidate;dihydrochloride |
Description: | Diethyl malonimidate dihydrochloride (CAS# 10344-69-1) is a useful research chemical compound. |
Molecular Weight: | 231.12 |
Molecular Formula: | C7H16Cl2N2O2 |
Canonical SMILES: | CCOC(=N)CC(=N)OCC.Cl.Cl |
InChI: | InChI=1S/C7H14N2O2.2ClH/c1-3-10-6(8)5-7(9)11-4-2;;/h8-9H,3-5H2,1-2H3;2*1H |
InChI Key: | TWUQXVGHXWRUBR-UHFFFAOYSA-N |
Boiling Point: | 171.8 °C at 760 mmHg |
Melting Point: | 122 °C (dec.)(lit.) |
Purity: | 95 % |
Appearance: | White to yellow powder or crystalline powder |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD00054633 |
LogP: | 3.20750 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021076681-A1 | Process for synthesis of picolinamides | 20191018 |
US-2018071244-A1 | Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies | 20151028 |
US-2019175541-A1 | Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies | 20151028 |
US-2019183843-A9 | Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies | 20151028 |
WO-2017075052-A1 | Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies | 20151028 |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.0588831 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.0588831 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 66.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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