Methyl (4-methyl-3-pyridinyl)carbamate

Basic Information

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CAS Number

694495-63-1

Molecular Formula

C8H10N2O2

Molecular Weight

166.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

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CC1=C(C=NC=C1)NC(=O)OC

InChI

InChI=1S/C8H10N2O2/c1-6-3-4-9-5-7(6)10-8(11)12-2/h3-5H,1-2H3,(H,10,11)

InChIKey

FTEFYIXMXZZAGN-UHFFFAOYSA-N

LogP

1.5683199999999997

Topological Polar Surface Area

51.22 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

161

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Methyl (4-methyl-3-pyridinyl)carbamate
3-Methoxycarbonylamino-4-methylpyridine
AKOS006283447
J-521709
FT-0764222
Methyl 4-methylpyridin-3-ylcarbamate
CS-M3531
Methyl (4-Methyl-3-pyridyl)carbamate
methyl (4-methylpyridin-3-yl)carbamate
SCHEMBL692100
MFCD09030045
ME-0097
FTEFYIXMXZZAGN-UHFFFAOYSA-N
A914570
SY060891
(4-Methyl-pyridin-3-yl)-carbamic Acid Methyl Ester
694495-63-1
DTXSID20470362
Carbamic acid, (4-methyl-3-pyridinyl)-, methyl ester
BCP13436
EN300-189034
Methyl N-(4-methylpyridin-3-yl)carbamate
methyl(4-methylpyridin-3-yl)carbamate
3-METHOXYCARBONYLAMINO-4-METHYLPYRIDINE
METHYL (4-METHYLPYRIDIN-3-YL)CARBAMATE
METHYL N-(4-METHYLPYRIDIN-3-YL)CARBAMATE
(4-methylpyridin-3-yl)carbamic acid methyl ester
methyl 4-methylpyridin-3-ylcarbamate
methylmethylpyridinylcarbamate
O-methyl-N-(4-methylpyridin-3-yl)carbamate
Carbamicacid,N-(4-methyl-3-pyridinyl)-,methylester

MDL Number

MFCD09030045

Customs Code

2933399090

FAQ

What are the physical and chemical properties of Methyl (4-methyl-3-pyridinyl)carbamate (CAS: 694495-63-1)?

Methyl (4-methyl-3-pyridinyl)carbamate is a crystalline solid with a molecular weight of approximately 196.22 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. The compound is moderately reactive, particularly with strong acids or bases. It decomposes upon prolonged exposure to heat or light.

How is Methyl (4-methyl-3-pyridinyl)carbamate (CAS: 694495-63-1) typically synthesized?

Methyl (4-methyl-3-pyridinyl)carbamate is typically synthesized by the reaction of methyl isocyanate with 4-methyl-3-pyridine alcohol. This process requires mild conditions and is catalyzed by a suitable acid or base. The yield is around 85%, and the product is isolated by recrystallization from an appropriate solvent.

What industries use Methyl (4-methyl-3-pyridinyl)carbamate (CAS: 694495-63-1)?

Methyl (4-methyl-3-pyridinyl)carbamate is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the production of polymers and in the development of sensors and semiconductors due to its chemical reactivity and stability under various conditions.

What precautions should be taken when handling Methyl (4-methyl-3-pyridinyl)carbamate (CAS: 694495-63-1)?

When handling Methyl (4-methyl-3-pyridinyl)carbamate, it is essential to wear personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to avoid inhalation. Spills should be carefully cleaned up using appropriate materials, and the area should be well-ventilated. Safety data sheets (SDS) should be consulted for detailed information on handling and disposal.