4-Chloro-6,8-dimethyl-2-phenylquinoline - CAS 101602-31-7
Catalog: |
BB000565 |
Product Name: |
4-Chloro-6,8-dimethyl-2-phenylquinoline |
CAS: |
101602-31-7 |
Synonyms: |
4-chloro-6,8-dimethyl-2-phenylquinoline |
IUPAC Name: | 4-chloro-6,8-dimethyl-2-phenylquinoline |
Description: | 4-Chloro-6,8-dimethyl-2-phenylquinoline (CAS# 101602-31-7) is a useful research chemical. |
Molecular Weight: | 267.75 |
Molecular Formula: | C17H14ClN |
Canonical SMILES: | CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)Cl)C |
InChI: | InChI=1S/C17H14ClN/c1-11-8-12(2)17-14(9-11)15(18)10-16(19-17)13-6-4-3-5-7-13/h3-10H,1-2H3 |
InChI Key: | MCCJMSALUBTGDI-UHFFFAOYSA-N |
Boiling Point: | 409.2 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.181 g/cm3 |
LogP: | 5.17200 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 300 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.0814771 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.0814771 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.2 |
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