6-Methylquinoline

HCID 7059

Basic information

CAS
91-62-3
Standard SMILES
Cc1ccc2ncccc2c1
InChIKey
LUYISICIYVKBTA-UHFFFAOYSA-N
Molecular formula
C10H9N
Average molar mass
143.18 g/mol
Monoisotopic mass
143.07349929

Overview

6-methylquinoline appears as clear pale yellow liquid or oil. (NTP, 1992)

Names & identifiers

Preferred name
6-Methylquinoline
IUPAC
6-methylquinoline
English name
6-Methylquinoline
Molecular formula
C10H9N
Molecular weight
143.19

Names & synonyms

6-METHYLQUINOLINE91-62-3p-ToluquinolineQuinoline, 6-methyl-FEMA No. 2744DTXSID3020887NSC-4152K14453I13NDTXCID50887RefChem:105058202-084-6p-Methylquinoline
Show more names
7-bromo-6-chloroquinazolin-4(3H)-onePARA METHYL QUINOLINEFEMA 27446-methyquinoline6-Methylchinolin6-methyl-quinolin6-Methylquinoline50
6-methyl-QuinolineTolliquinoline, p-CCRIS 407NSC 4152MFCD00006804Quinoline, 6-methyl- (8CI,9CI)CAS-91-62-36-methyl quinoline

Database identifiers

CAS
91-62-3
PubChem CID
7059
DTXSID
DTXSID3020887
ChEMBL
CHEMBL1412508
ChEBI
CHEBI:140761
UNII
K14453I13N
EC Number
202-084-6
Nikkaji
J800A

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11

Experimental & physicochemical properties

SpringerMaterials PropertiesBoiling point
FragrancesFragrance Ingredient (6-Methylquinoline) -> IFRA transparency List
LogP2.57
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density · 2 items

1.0654 at 68 °F (NTP, 1992) - Denser than water; will sink

1.060-1.066

Flavoring AgentsEU Flavoring substances

Physicochemical properties

Melting point
-22 °C · -22°C
Boiling point
256 · 256-260 °C (lit.)
Density
1.067 g/mL · 1.067 g/mL at 20 °C (lit.)
vapor density
1 · >1 (vs air)
refractive index
20 · n20/D 1.614(lit.)
FEMA
2744 · 2744 | 6-METHYLQUINOLINE

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 1647 reports by companies from 4 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 3 items

Chemical: Quinoline, 6-methyl-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

6-Methylquinoline: Does not have an individual approval but may be used under an appropriate group standard

Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: This compound may be absorbed through the skin and it causes skin irritation. The vapor or mist is irritating to the eyes, mucous membranes and upper respiratory tract.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 item

6-METHYLQUINOLINE is sensitive to prolonged exposure to light. May react vigorously with strong oxidizing agents and strong acids (NTP, 1992). Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.

Air and Water ReactionsInsoluble in water.

Safety & protection

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 item

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 item

SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 item

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Safety data

PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
rtecs
VC0550000
hs_code
29334990
risk_code
22-38-68-36/37/38

Chemistry & industry

Pharmacology

Cellular LocationsMembrane

Uses & manufacturing

Use Classification · 4 items

Fragrance Ingredients

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing InformationQuinoline, 6-methyl-: ACTIVE
Applications · 3 items

OccurrenceReported found in Finnish and Japanese whiskey.

Uses6-Methylquinoline can be used as primary carbon source in culture of Pseudomonas putida QP1. 6-Methylquinoline was used in the synthesis of fluorescent halide-sensitive quinolinium dyes and fluorescent probes for determination of chloride in biological systems.

General DescriptionClear pale yellow liquid or oil with a quinoline odor.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
江西益众化工有限公司15307925109 15350027073 · [email protected]
阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]

Additional notes

DefinitionChEBI: 6-methylquinoline is a member of quinolines.

Related reactions

34 records

Compound notes

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