1,3,3-trimethyl-2H-quinolin-4-one

Modify Date: 2025-09-27 19:51:18

1,3,3-trimethyl-2H-quinolin-4-one Structure
1,3,3-trimethyl-2H-quinolin-4-one structure
Common Name 1,3,3-trimethyl-2H-quinolin-4-one
CAS Number 53207-52-6 Molecular Weight 189.25400
Density 1.038g/cm3 Boiling Point 293.6ºC at 760 mmHg
Molecular Formula C12H15NO Melting Point N/A
MSDS N/A Flash Point 106.3ºC

 Names

Name 1,3,3-trimethyl-2H-quinolin-4-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.038g/cm3
Boiling Point 293.6ºC at 760 mmHg
Molecular Formula C12H15NO
Molecular Weight 189.25400
Flash Point 106.3ºC
Exact Mass 189.11500
PSA 20.31000
LogP 2.41030
Index of Refraction 1.528
InChIKey CDRRBVFIMBIPIT-UHFFFAOYSA-N
SMILES CN1CC(C)(C)C(=O)c2ccccc21

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VC8420000
CHEMICAL NAME :
4-Quinolinone, 1,2,3,4-tetrahydro-1,3,3-trimethyl-
CAS REGISTRY NUMBER :
53207-52-6
BEILSTEIN REFERENCE NO. :
1453399
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-N-O
MOLECULAR WEIGHT :
189.28
WISWESSER LINE NOTATION :
T66 BN EVT&J B1 D1 D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
193 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 17,819,1974

 Safety Information

HS Code 2933499090

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

1,3,3-trimethyl-2,3-dihydro-1H-quinolin-4-one
1,3,3-Trimethyl-2,3-dihydro-4(1H)-quinolinone
4-Quinolinone,1,2,3,4-tetrahydro-1,3,3-trimethyl
1,2,3,4-Tetrahydro-1,3,3-trimethyl-4-quinolinone
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