CAS 50358-38-8 6-Methoxyquinolin-5-amine (HCID 459671)

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Basic information

CAS: 50358-38-8
Standard SMILES: COc1ccc2ncccc2c1N
InChIKey: LTDUAVSGOSFGMV-UHFFFAOYSA-N
Molecular formula: C10H10N2O
Average molar mass: 174.2 g/mol
Monoisotopic mass: 174.07931294

Names & identifiers

Preferred name: 6-Methoxyquinolin-5-amine
IUPAC: 6-methoxyquinolin-5-amine
English name: 6-Methoxyquinolin-5-aMine
Molecular formula: C10H10N2O
Molecular weight: 174.2

Names & synonyms

6-methoxyquinolin-5-amine50358-38-8DTXSID40332690RefChem:308858DTXCID30283783890-960-45-Amino-6-methoxyquinolineMFCD120678815-Quinolinamine, 6-methoxy-F2197-0018SCHEMBL8396592LTDUAVSGOSFGMV-UHFFFAOYSA-N

Show more names

ACA35838AKOS009996263SB67666AS-49735SY240297DB-350609EN300-235056K10154

Database identifiers

CAS: 50358-38-8
PubChem CID: 459671
DTXSID: DTXSID40332690
EC Number: 890-960-4
Nikkaji: J1.428.469I

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 48.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 174

Physicochemical properties

Melting point: 154 · 154-156 °C(Solv: ligroine (8032-32-4))
Boiling point: 341.1 · 341.1±27.0 °C(Predicted)
Density: 1.217 · 1.217±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, protect from light
pka: 5.6 · 5.60±0.15(Predicted)
Appearance: Light yellow to green yellow Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.