Undecanoyl chloride - CAS 17746-05-3
Catalog: |
BB013292 |
Product Name: |
Undecanoyl chloride |
CAS: |
17746-05-3 |
Synonyms: |
undecanoyl chloride |
IUPAC Name: | undecanoyl chloride |
Description: | Undecanoyl chloride (CAS# 17746-05-3) is an analog of Heptanoyl Chloride (H281235), which is used in the synthesis of novel class of 2-Aminopyrimidines as CDK1 and CDK2 inhibitors. |
Molecular Weight: | 204.74 |
Molecular Formula: | C11H21ClO |
Canonical SMILES: | CCCCCCCCCCC(=O)Cl |
InChI: | InChI=1S/C11H21ClO/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3 |
InChI Key: | JUKPJGZUFHCZQI-UHFFFAOYSA-N |
Boiling Point: | 135-136 °C (20 mmHg) |
Purity: | 95 % |
Density: | 0.93 g/mL at 25 |
Appearance: | Colorless liquid |
Storage: | -20 °C |
MDL: | MFCD00000739 |
LogP: | 4.28260 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
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Complexity: | 123 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.1280930 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.1280930 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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