Dodecanenitrile - CAS 2437-25-4
Catalog: |
BB018446 |
Product Name: |
Dodecanenitrile |
CAS: |
2437-25-4 |
Synonyms: |
dodecanenitrile |
IUPAC Name: | dodecanenitrile |
Description: | Dodecanenitrile (CAS# 2437-25-4) is a useful research chemical compound. |
Molecular Weight: | 181.32 |
Molecular Formula: | C12H23N |
Canonical SMILES: | CCCCCCCCCCCC#N |
InChI: | InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3 |
InChI Key: | VXCUURYYWGCLIH-UHFFFAOYSA-N |
Boiling Point: | 198 °C (100 mmHg) |
Melting Point: | 4°C |
Flash Point: | 114°C |
Density: | 0.827 g/cm3 |
Appearance: | Colorless liquid |
Storage: | Store in a cool, dry place. Store in a tightly closed container. |
MDL: | MFCD00001946 |
LogP: | 4.43088 |
Refractive Index: | 1.435-1.437 |
GHS Hazard Statement: | H315 (86.33%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P273, P280, P302+P352, P321, P332+P313, P362, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112745993-A | Microcapsule essence and preparation method and application thereof | 20201228 |
CN-112708102-A | Synthesis of waterborne polyurethane dispersion containing quadruple hydrogen bonds based on ureido triazine structure and preparation method thereof | 20201217 |
CN-111635334-A | Method for generating nitrile by catalyzing primary amine acceptor-free dehydrogenation through Ru complex | 20200713 |
JP-2020143060-A | Non-aqueous electrolyte solution and non-aqueous electrolyte battery using it | 20200407 |
JP-6851527-B2 | Non-aqueous electrolyte solution and non-aqueous electrolyte battery using it | 20200407 |
Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.183049738 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.183049738 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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