Butyl nicotinate

Basic Information

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CAS Number

6938-06-3

Molecular Formula

C10H13NO2

Molecular Weight

179.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

252 °C

Boiling Point

252°C

Density

1.06

Flash Point

113 °C

Refractive Index

n20/D 1.495(lit.)

SMILES

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CCCCOC(=O)C1=CN=CC=C1

InChI

InChI=1S/C10H13NO2/c1-2-3-7-13-10(12)9-5-4-6-11-8-9/h4-6,8H,2-3,7H2,1H3

InChIKey

DQULIMIQTCDUAN-UHFFFAOYSA-N

LogP

2.0385

Topological Polar Surface Area

39.19 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

159

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

NS00044318
CHEMBL1490443
AI3-15771
Nicotinic acid n-butyl ester
5-22-02-00060 (Beilstein Handbook Reference)
NSC 53506
pyridine-3-carboxylic acid butyl ester
HMS2270P03
SMR000528250
Butyl nicotinate
BA-2674
NSC 27863
MFCD00006390
FT-0636295
A23902
Butylnicotinate
AKOS015891718
3-Pyridinecarboxylic acid, butyl ester
CS-0152098
MLS000737289
SCHEMBL551716
6938-06-3
UNII-LD3V8A23CV
Butyl 3-pyridinecarboxylate
WLN: T6NJ CVO4
butyl pyridine-3-carboxylate
NSC27863
NCGC00246830-01
n-Butyl nicotinate
BRN 0132654
LD3V8A23CV

MDL Number

MFCD00006390

Customs Code

2933399090

FAQ

What is Butyl nicotinate (CAS: 6938-06-3)?

Butyl nicotinate is an organic compound with the CAS number 6938-06-3. It is a colorless liquid with a slightly bitter taste and a characteristic odor. It is used in pharmaceuticals, cosmetics, and as a solvent in various applications.

What are the main uses of Butyl nicotinate (CAS: 6938-06-3)?

Butyl nicotinate is primarily used in pharmaceuticals as a topical anesthetic and vasodilator. It is also used in cosmetics as an ingredient in skincare products and as a solvent in the formulation of various chemical products.

Is Butyl nicotinate (CAS: 6938-06-3) safe?

Butyl nicotinate is generally considered safe when used as directed. However, it should be handled with care, as ingestion can cause irritation and other adverse effects. Protective measures include wearing gloves and avoiding contact with the eyes and skin.

How should Butyl nicotinate (CAS: 6938-06-3) be stored?

Butyl nicotinate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to protect it from moisture and light. The storage temperature should not exceed 25°C (77°F).