2,6-Dichloroquinoline-3-carbonitrile - CAS 948291-61-0
Catalog: |
BB041534 |
Product Name: |
2,6-Dichloroquinoline-3-carbonitrile |
CAS: |
948291-61-0 |
Synonyms: |
2,6-dichloroquinoline-3-carbonitrile |
IUPAC Name: | 2,6-dichloroquinoline-3-carbonitrile |
Description: | 2,6-Dichloroquinoline-3-carbonitrile (CAS# 948291-61-0) is a useful research chemical. |
Molecular Weight: | 223.06 |
Molecular Formula: | C10H4Cl2N2 |
Canonical SMILES: | C1=CC2=C(C=C1Cl)C=C(C(=N2)Cl)C#N |
InChI: | InChI=1S/C10H4Cl2N2/c11-8-1-2-9-6(4-8)3-7(5-13)10(12)14-9/h1-4H |
InChI Key: | VITYMWFVJDUOBD-UHFFFAOYSA-N |
Boiling Point: | 380.8 °C at 760 mmHg |
Density: | 1.49 g/cm3 |
LogP: | 3.41328 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 260 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.9751535 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.9751535 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 36.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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Related Functional Groups
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