2-Chloro-6-methylquinoline-3-methanol - CAS 123637-97-8
Catalog: |
BB005733 |
Product Name: |
2-Chloro-6-methylquinoline-3-methanol |
CAS: |
123637-97-8 |
Synonyms: |
(2-chloro-6-methylquinolin-3-yl)methanol |
IUPAC Name: | (2-chloro-6-methylquinolin-3-yl)methanol |
Description: | 2-Chloro-6-methylquinoline-3-methanol (CAS# 123637-97-8) is a useful research chemical. |
Molecular Weight: | 207.66 |
Molecular Formula: | C11H10ClNO |
Canonical SMILES: | CC1=CC2=CC(=C(N=C2C=C1)Cl)CO |
InChI: | InChI=1S/C11H10ClNO/c1-7-2-3-10-8(4-7)5-9(6-14)11(12)13-10/h2-5,14H,6H2,1H3 |
InChI Key: | JYQVWLZEYAYKHI-UHFFFAOYSA-N |
Boiling Point: | 368.7 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.307 g/cm3 |
LogP: | 2.68890 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2013018064-A1 | Amino Heteroaryl Compounds as Beta-Secretase Modulators and Methods of Use | 20091123 |
US-8822485-B2 | Amino heteroaryl compounds as beta-secretase modulators and methods of use | 20091123 |
PMID | Publication Date | Title | Journal |
21587790 | 20100605 | (2-Chloro-6-methyl-quinolin-3-yl)methanol | Acta crystallographica. Section E, Structure reports online |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.0450916 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.0450916 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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Quinoline/Isoquinoline
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