3,3-Diethoxypropionitrile - CAS 2032-34-0
Catalog: |
BB015798 |
Product Name: |
3,3-Diethoxypropionitrile |
CAS: |
2032-34-0 |
Synonyms: |
3,3-diethoxypropanenitrile |
IUPAC Name: | 3,3-diethoxypropanenitrile |
Description: | 3,3-Diethoxypropionitrile (CAS# 2032-34-0) is a propionitrile derivative used in the preparation of various biologically active compounds such as p38α mitogen-activated protein kinase inhibitors. |
Molecular Weight: | 143.18 |
Molecular Formula: | C7H13NO2 |
Canonical SMILES: | CCOC(CC#N)OCC |
InChI: | InChI=1S/C7H13NO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-5H2,1-2H3 |
InChI Key: | WBOXEOCWOCJQNK-UHFFFAOYSA-N |
Boiling Point: | 91-93 °C (11 mmHg) |
Density: | 0.954 g/cm3 |
Appearance: | Clear yellow to brownish liquid |
MDL: | MFCD00040558 |
LogP: | 1.29918 |
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 |
CN-112321599-A | Synthesis method of drug intermediate 7-oxo-2-azaspiro [3.5] nonane | 20201125 |
CN-111646947-A | Preparation process for replacing sodium methoxide by metal sodium in cytosine cyclization process | 20200714 |
WO-2021110169-A1 | Thiazololactam compound as erk inhibitor and use thereof | 20191206 |
WO-2021059160-A1 | Process for preparing 5-(fluoro-4-imino-3-methyl)-1-tosyl-3,4 dihydropyrimidine -(1h)-one | 20190923 |
CN-109912454-A | The synthetic method of 3- ethoxy propylene nitrile and 3,3- diethoxy propionitrile mixture | 20190326 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.094628657 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 42.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS