2-Chloro-6-methoxy-3-phenylquinoline - CAS 85274-57-3
Catalog: |
BB037571 |
Product Name: |
2-Chloro-6-methoxy-3-phenylquinoline |
CAS: |
85274-57-3 |
Synonyms: |
2-chloro-6-methoxy-3-phenylquinoline |
IUPAC Name: | 2-chloro-6-methoxy-3-phenylquinoline |
Description: | 2-Chloro-6-methoxy-3-phenylquinoline (CAS# 85274-57-3) is a useful research chemical. |
Molecular Weight: | 269.73 |
Molecular Formula: | C16H12ClNO |
Canonical SMILES: | COC1=CC2=CC(=C(N=C2C=C1)Cl)C3=CC=CC=C3 |
InChI: | InChI=1S/C16H12ClNO/c1-19-13-7-8-15-12(9-13)10-14(16(17)18-15)11-5-3-2-4-6-11/h2-10H,1H3 |
InChI Key: | GGBHOBDCDNXFFD-UHFFFAOYSA-N |
Boiling Point: | 400.6 ℃ at 760 mmHg |
Density: | 1.237 g/cm3 |
LogP: | 4.56380 |
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: | 293 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 269.0607417 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 269.0607417 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 22.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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