2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (1:1)

Basic Information

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CAS Number

70918-74-0

Molecular Formula

C13H17ClN2O3

Molecular Weight

284.74 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

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

263°C

Boiling Point

437.2 °C at 760 mmHg

Flash Point

218.2 °C

SMILES

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C1CN(CCN1)C(=O)C2COC3=CC=CC=C3O2.Cl

InChI

InChI=1S/C13H16N2O3.ClH/c16-13(15-7-5-14-6-8-15)12-9-17-10-3-1-2-4-11(10)18-12;/h1-4,12,14H,5-9H2;1H

InChIKey

TUKBWYXLYINULI-UHFFFAOYSA-N

LogP

0.6799999999999999

Topological Polar Surface Area

50.800000000000004 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

305

Safety Information

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Hazard Statement

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

SCHEMBL8335181
2-(1-Piperazinylcarbonyl)-1,4-benzodioxane Hydrochloride
1-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine hydrochloride, AldrichCPR
1-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazine hydrochloride
N-[(1,4-Benzodioxane-2-yl)carboxyl] piperazine hydrochloride
CS-W002671
n-(1,4-benzodioxan-2-carbonyl)piperazinehydrochloride
1-(1,4-benzodioxan-2-ylcarbonyl)piperazine hydrochloride
piperazine, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]-, monohydrochloride
AKOS015889671
Methanone, (2,3-dihydro-1,4-benzodioxin-2-yl)-1-piperazinyl-, hydrochloride (1:1)
TUKBWYXLYINULI-UHFFFAOYSA-N
FT-0641316
AS-35636
P1890
MFCD00729051
70918-74-0
SK3FQQ8W9N
1-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine hydrochloride;
1-[(2,3-Dihydro-1,4-benzodioxin-2-yl)carbonyl]piperazine Monohydrochloride
1-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine hydrochloride
(2,3-Dihydrobenzo[1,4]dioxin-2-yl)piperazin-1-yl-methanone hydrochloride
N-(1,4-Benzodioxan-2-Carbonyl)Piperazine Hydrochloride
1-[(2RS)-2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl]piperazine Hydrochloride
2-(1-Piperazinylcarbonyl)-1,4-benzodioxaneHydrochloride
(2,3-Dihydro-benzo[1,4]dioxin-2-yl)piperazine-1-yl-methanone hydrochloride
DTXSID00384918
EC 415-660-9
2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride
(2,3-DIHYDRO-BENZO[1,4]DIOXIN-2-YL)-PIPERAZIN-1-YL-METHANONE HCL
Doxazosin Related Compou

MDL Number

MFCD00729051

Customs Code

2934999090

FAQ

What are the physical and chemical properties of 2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0)?

2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0) is a crystalline compound. Its molecular weight is approximately 307.68 g/mol. It is soluble in water and less soluble in organic solvents. The compound is known for its stability under normal conditions but may exhibit reactivity when exposed to strong acids or bases. It is important for storage and handling to ensure compatibility with the storage environment.

How is 2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0) typically synthesized?

2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0) is typically synthesized by the condensation of 2,3-dihydro-1,4-benzodioxin-2-one with 1-piperazinecarboxylic acid. The reaction is usually catalyzed by a suitable base, and the product is obtained with good yield. The synthesis is carried out under mild conditions, and the product is isolated by recrystallization from an appropriate solvent.

What industries use 2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0)?

2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0) is primarily used in the pharmaceutical industry for its potential as a drug intermediate. It also finds applications in the polymer industry for its chemical properties. Additionally, it may be used in the development of sensors and semiconductors due to its unique structural characteristics.

What precautions should be taken when handling 2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0)?

When handling 2,3-Dihydro-1,4-benzodioxin-2-yl(1-piperazinyl)methanone hydrochloride (CAS: 70918-74-0), it is important to use appropriate personal protective equipment (PPE), including gloves and safety goggles. Work should be conducted in a well-ventilated area or a fume hood. In the event of a spill, immediately clean up using appropriate absorbents and follow local safety guidelines. It is also advisable to have a safety data sheet (SDS) readily available for reference.