4-Pentynenitrile - CAS 19596-07-7
Catalog: |
BB015176 |
Product Name: |
4-Pentynenitrile |
CAS: |
19596-07-7 |
Synonyms: |
pent-4-ynenitrile |
IUPAC Name: | pent-4-ynenitrile |
Description: | 4-Pentynenitrile (CAS# 19596-07-7) is a useful research chemical. |
Molecular Weight: | 79.10 |
Molecular Formula: | C5H5N |
Canonical SMILES: | C#CCCC#N |
InChI: | InChI=1S/C5H5N/c1-2-3-4-5-6/h1H,3-4H2 |
InChI Key: | VMUWIDHKAIGONP-UHFFFAOYSA-N |
Boiling Point: | 169 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 0.88 g/cm3 |
MDL: | MFCD00041563 |
LogP: | 0.92338 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021253556-A1 | Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (enpp1) and methods of use thereof | 20200204 |
WO-2021158829-A1 | Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (enpp1) and methods of use thereof | 20200204 |
CN-111187292-A | Method for synthesizing α -vinyl silane under heterogeneous condition | 20200109 |
CN-111187292-B | Method for synthesizing alpha-vinyl silane under heterogeneous condition | 20200109 |
US-2021128744-A1 | Thienoazepine immunoconjugates, and uses thereof | 20191025 |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 79.042199164 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 79.042199164 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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