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Basic information
- CAS
1333-58-0- Standard SMILES
CC(C)Cc1ccnc2ccccc12- InChIKey
ZFIHCQGXRHANID-UHFFFAOYSA-N- Molecular formula
- C13H15N
- Average molar mass
- 185.27 g/mol
- Monoisotopic mass
- 185.12044948
Names & identifiers
- Preferred name
- 4-(2-Methylpropyl)quinoline
- IUPAC
- 4-(2-Methylpropyl)quinoline
- English name
- 6-Isobutylquinoline
- Molecular formula
- C13H15N
- Molecular weight
- 185.26
Names & synonyms
ISOBUTYL QUINOLINE6-Isobutylquinoline(2-methylpropyl)-Quinoline4-(2-methylpropyl)quinolineQuinoline,(2-methylpropyl)-QUINOLINE, 6-SECONDARY BUTYL
Database identifiers
- CAS
1333-58-0、7661-51-0- PubChem CID
- 74005
- DTXSID
DTXSID80892309- EC Number
- 215-598-0
- Nikkaji
- J113.674G
Properties
Physicochemical properties
- Odor
- 1 % · at 1.00 % in dipropylene glycol. leather animal herbal green
- Odor Type
- animal
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 4.185 · 4.185
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- Quinoline, (2-methylpropyl)- (1333-58-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- TSCA
- TSCA listed
- Toxicity
- 50 value · The acute oral LD50 value in rats was reported as 1.02 g/kg (0.78-1.26 g/kg) (Moreno, 1973). The acute dermal LD50 value in rabbits was reported as > 5 g/kg (Moreno, 1973).
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- Toxicity
- The acute oral LD50 value in rats was reported as 1.02 g/kg (0.78-1.26 g/kg) (Moreno, 1973). The acute dermal LD50 value in rabbits was reported as > 5 g/kg (Moreno, 1973).
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
OccurrenceHas apparently not been reported to occur in nature
Preparation methods
PreparationFrom acrolein and secondary butylaniline followed by dehydration and oxidation
Suppliers1 total
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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