Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate

Basic Information

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CAS Number

14678-87-6

Molecular Formula

C12H12ClN3O2

Molecular Weight

265.7 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 Amines

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

Boiling Point

408.4°C at 760 mmHg

SMILES

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CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C12H12ClN3O2/c1-2-18-12(17)10-7-15-16(11(10)14)9-5-3-8(13)4-6-9/h3-7H,2,14H2,1H3

InChIKey

IWCZALNAGZMKIV-UHFFFAOYSA-N

LogP

2.2846

Topological Polar Surface Area

70.14 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

295

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

SR-01000910803
SY083015
(4R,5R)-N,N'-Bis[11-(ethoxycarbonyl)undecyl]-N,N',4,5-tetramethyl-3,6-dioxaoctanediamide
ethyl5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate
CS-0061566
AKOS000260328
ethyl 5-amino-1-(4-chlorophenyl)pyrazole-4-carboxylate
FT-0637124
DTXSID10399336
5-AMINO-1-(4-CHLORO-PHENYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
SCHEMBL6527991
Z55148825
F2135-0799
1H-Pyrazole-4-carboxylicacid,5-amino-1-(4-chlorophenyl)-,ethyl ester
ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate
A3207
EN300-110826
AS-11264
AMY12007
1H-Pyrazole-4-carboxylic acid, 5-amino-1-(4-chlorophenyl)-, ethyl ester
IWCZALNAGZMKIV-UHFFFAOYSA-N
F17255
J-008262
14678-87-6
5-Amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylic acid ethyl ester
MFCD00973905
SR-01000910803-1
Ethyl 5-amino-1-(4-chlorophenyl)-pyrazole-4-carboxylate
Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate
Pyrazole-4-carboxylicacid, 5-amino-1-(p-chlorophenyl)-, ethyl ester (6CI,7CI,8CI)
5-Amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylicacid ethyl ester

MDL Number

MFCD00973905

Customs Code

2933199090

FAQ

What regulatory guidelines apply to Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate (CAS: 14678-87-6)?

Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate (CAS: 14678-87-6) is subject to various regulatory guidelines including GHS classification for hazardous chemicals, REACH regulations in the European Union, and FDA/EPA requirements for use and disposal in the U.S. and other regions. Producers and consumers should comply with local and international laws concerning the handling, storage, and disposal of this compound.

Are there alternatives to Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate in synthesis?

Several alternatives to Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate can be used in synthesis, including other amino derivatives or isosteres such as 4-chloro-5-amino-1-phenylpyrazole. Common alternative reagents include similar chloroaromatic compounds or different functional groups that can be substituted for the ethyl group, depending on the desired outcome and reaction conditions.

What is the market or research trend for Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate?

The market for Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate (CAS: 14678-87-6) is driven by its application in pharmaceuticals and as a key intermediate in organic synthesis. Recent research trends focus on its use in drug discovery and development, with an increasing emphasis on its potential as a bioactive compound. Market trends indicate a growing interest in its synthesis and use, supported by ongoing advancements in synthetic chemistry.

How should waste containing Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate (CAS: 14678-87-6) be handled?

Waste containing Ethyl 5-amino-1-(4-chlorophenyl)-1H-pyrazole-4-carboxylate (CAS: 14678-87-6) should be handled according to local and international waste management regulations. Collect waste in appropriate containers, ensuring it is labeled with its contents and any associated hazards. Incineration or professional waste disposal services are recommended for safe disposal. Proper environmental protection measures, such as containment and prevention of spills, should be followed to avoid contamination of soil and water sources.