CAS 120-15-0 Quinoline, 1,2,3,4-tetrahydro-6-methoxy- (HCID 67113)

Names & identifiers

Preferred name: Quinoline, 1,2,3,4-tetrahydro-6-methoxy-
IUPAC: 6-methoxy-1,2,3,4-tetrahydroquinoline
English name: 6-METHOXY-1,2,3,4-TETRAHYDROQUINOLINE
Molecular formula: C10H13NO
Molecular weight: 163.22

Names & synonyms

6-Methoxy-1,2,3,4-tetrahydroquinoline120-15-0ThallinThallineQuinoline, 1,2,3,4-tetrahydro-6-methoxy-6-Methoxytetrahydroquinoline1,2,3,4-Tetrahydro-6-methoxyquinolineEA6AYU7Y78Methyl 1,2,3,4-tetrahydro-6-quinolyl etherEINECS 204-374-8NSC 49188NSC-49188

Show more names

AKOS BB-9796TIMTEC-BB SBB002326SALOR-INT L308625-1EADebrisoquine Impurity 116-Methoxy-1,2,3,4-tetrahydroquinoline 99%

Quinoline l,2,3,4-tetrahydro-6-methoxyDTXSID3059505RefChem:871981DTXCID7033529204-374-86-Methoxy-1,2,3,4-tetrahydro-quinolineMFCD00090494UNII-EA6AYU7Y78

Database identifiers

CAS: 120-15-0
PubChem CID: 67113
DTXSID: DTXSID3059505
UNII: EA6AYU7Y78
EC Number: 204-374-8
Nikkaji: J5.320A

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 21.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 149

Physicochemical properties

Melting point: 37 · 37-41 °C (lit.)
Boiling point: 290.31 °C · 290.31°C (rough estimate)
Density: 1.0508 · 1.0508 (rough estimate)
refractive index: 1.5718 · 1.5718 (estimate)
RTECS: 2940000 · VC2940000
Flash point: 230 °F · >230 °F
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
pka: 5.95 · 5.95±0.20(Predicted)
InChI: 1S/C10H13NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h4-5,7,11H,2-3,6H2,1H3
InChIKey: FRXSZNDVFUDTIR-UHFFFAOYSA-N
SMILES: COc1ccc2NCCCc2c1
CAS DataBase Reference: 120 · 120-15-0(CAS DataBase Reference)
FDA UNII: 6 AYU7Y78 · EA6AYU7Y78
EPA Substance Registry System: 1 · Quinoline, 1,2,3,4-tetrahydro-6-methoxy- (120-15-0)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338-P280a-P304+P340-P405-P501a
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36/37
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: IRRITANT
HS Code: 2933499090 · 2933499090
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
tsca: TSCA listed
hs_code: 2933499090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36/37
hazard_class: IRRITANT
Storage Class: 11 - Combustible Solids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P305+P351+P338-P280a-P304+P340-P405-P501a

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationQuinoline, 1,2,3,4-tetrahydro-6-methoxy-: INACTIVE

Applications

Uses1,2,3,4-Tetrahydro-6-methoxyquinoline is used as chemical reagents, organic intermediates, fine chemicals, pharmaceutical research and development.