Cyclopropylacetonitrile - CAS 6542-60-5
Catalog: |
BB032728 |
Product Name: |
Cyclopropylacetonitrile |
CAS: |
6542-60-5 |
Synonyms: |
Cyclopropaneacetonitrile; (Cyanomethyl)cyclopropane; Cyclopropylcarbinyl cyanide; Cyclopropylmethyl cyanide |
IUPAC Name: | 2-cyclopropylacetonitrile |
Molecular Weight: | 81.12 |
Molecular Formula: | C5H7N |
Canonical SMILES: | C1CC1CC#N |
InChI: | InChI=1S/C5H7N/c6-4-3-5-1-2-5/h5H,1-3H2 |
InChI Key: | FAUQRRGKJKMEIW-UHFFFAOYSA-N |
Boiling Point: | 142-144°C |
Purity: | ≥95% |
Density: | 0.963±0.06 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD00041523 |
LogP: | 1.31008 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P201, P202, P210, P233, P240, P241, P242, P243, P280, P281, P302+P352, P303+P361+P353, P308+P313, P312, P322, P361, P363, P370+P378, P403+P235, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021087135-A1 | Branched tail lipid compounds and compositions for intracellular delivery of therapeutic agents | 20190919 |
WO-2021055833-A1 | Branched tail lipid compounds and compositions for intracellular delivery of therapeutic agents | 20190919 |
US-11066355-B2 | Branched tail lipid compounds and compositions for intracellular delivery of therapeutic agents | 20190919 |
WO-2021043077-A1 | Substituted pyrazine compound and preparation method therefor and use thereof | 20190906 |
CN-110386888-A | A kind of inexpensive, high yield 1- (thiopurine methyltransferase) cyclopropaneacetic acid production technology | 20190730 |
Complexity: | 83.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 81.057849228 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 81.057849228 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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