4-Amino-2,6,8-trimethylquinoline - CAS 689277-05-2
Catalog: |
BB033659 |
Product Name: |
4-Amino-2,6,8-trimethylquinoline |
CAS: |
689277-05-2 |
Synonyms: |
2,6,8-trimethylquinolin-4-amine |
IUPAC Name: | 2,6,8-trimethylquinolin-4-amine |
Description: | 4-Amino-2,6,8-trimethylquinoline (CAS# 689277-05-2) is a useful research chemical. |
Molecular Weight: | 186.25 |
Molecular Formula: | C12H14N2 |
Canonical SMILES: | CC1=CC(=C2C(=C1)C(=CC(=N2)C)N)C |
InChI: | InChI=1S/C12H14N2/c1-7-4-8(2)12-10(5-7)11(13)6-9(3)14-12/h4-6H,1-3H3,(H2,13,14) |
InChI Key: | SLSWQXZTEPDTDH-UHFFFAOYSA-N |
Boiling Point: | 355.022 °C at 760 mmHg |
Density: | 1.109 g/cm3 |
LogP: | 3.32340 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2016022626-A1 | Heterocyclic cgrp receptor antagonists | 20140806 |
WO-2016022644-A1 | Heterocyclic cgrp receptor antagonists | 20140806 |
US-2012065166-A1 | Bone Modulators And Methods Therewith | 20090812 |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.115698455 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.115698455 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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Related Functional Groups
Quinoline/Isoquinoline
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