Basic information
- CAS
3562-69-4- Standard SMILES
CC1=CC(C)(C)Nc2ccc(-c3ccccc3)cc21- InChIKey
XKBGEVHKVFIMLY-UHFFFAOYSA-N- Molecular formula
- C18H19N
- Average molar mass
- 249.3 g/mol
- Monoisotopic mass
- 249.15174961
Names & identifiers
- Preferred name
- 1,2-Dihydro-2,2,4-trimethyl-6-phenylquinoline
- IUPAC
- 2,2,4-trimethyl-6-phenyl-1H-quinoline
- English name
- 1,2-Dihydro-2,2,4-treimethyl-6-phenylquinoline
- Molecular formula
- C18H19N
- Molecular weight
- 249.35
Names & synonyms
Santoflex B3562-69-42,2,4-Trimethyl-6-phenyl-1,2-dihydroquinoline1,2-Dihydro-2,2,4-trimethyl-6-phenylquinoline6-Phenyl-2,2,4-trimethyldihydroquinolineUT9B2V4JD4Quinoline, 1,2-dihydro-2,2,4-trimethyl-6-phenyl-DTXSID30189094RefChem:1052265DTXCID60111585CHEMBL93463USAF B-29
Show more names
LG-001447
UNII-UT9B2V4JD4BRN 01855281,2-DIHYDRO-2,2,4-TREIMETHYL-6-PHENYLQUINOLINE2,2,4-Trimethyl-6-phenyl-1,2-dihydro-quinoline4-20-00-04116 (Beilstein Handbook Reference)SCHEMBL311413SCHEMBL29373499BDBM50066527
Database identifiers
- CAS
3562-69-4- PubChem CID
- 77098
- DTXSID
DTXSID30189094- ChEMBL
CHEMBL93463- UNII
- UT9B2V4JD4
- Nikkaji
- J54.279B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 349
Experimental & physicochemical properties
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physicochemical properties
- Indirect Additives used in Food Contact Substances
- 1 · 1,2-DIHYDRO-2,2,4-TRIMETHYL-6-PHENYLQUINOLINE
- FDA 21 CFR
- 177.26 · 177.2600
- FDA UNII
- 9 B2V4JD4 · UT9B2V4JD4
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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