Methyl 3-iodo-1H-indazole-6-carboxylate

Basic Information

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CAS Number

885518-82-1

Molecular Formula

C9H7IN2O2

Molecular Weight

302.07 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Density

1.948±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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COC(=O)C1=CC2=NNC(=C2C=C1)I

InChI

InChI=1S/C9H7IN2O2/c1-14-9(13)5-2-3-6-7(4-5)11-12-8(6)10/h2-4H,1H3,(H,11,12)

InChIKey

VSXHXVGWOSYULI-UHFFFAOYSA-N

LogP

1.9540999999999997

Topological Polar Surface Area

54.98 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

237

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

Methyl 3-iodo-1H-indazole-6-carboxylate
1H-INDAZOLE-6-CARBOXYLIC ACID,3-IODO-,METHYL ESTER
3-Iodo-1H-indazole-6-carboxylic acid methyl ester
3-Iodo-6-(1H)indazole carboxylic acid methyl ester
3-Iodo-6-(1H)indazole carboxylic acid methyl ester
methyl 3-iodo-2H-indazole-6-carboxylate
Methyl 3-iodoindazole-6-carboxylate
3-Iodo-2H-indazole-6-carboxylic acid methyl ester
PubChem18069
KSC495C3D
VSXHXVGWOSYULI-UHFFFAOYSA-N
1H-INDAZOLE-6-CARBOXYLIC ACID, 3-IODO-, METHYL ESTER
BCP26281
methyl 3-iodo-1H-indazole-6-carboxylate
SY033613
MFCD07781616
AKOS005258561
DTXSID40646284
PB10467
885518-82-1
J-522184
3-Iodo-1H-indazole-6-carboxylic acid methyl ester, AldrichCPR
SCHEMBL2671519
EN300-316920
CS-0006094
DB-077908
methyl 3-iodo-1H-indazole 6-carboxylate
METHYL 3-IODOINDAZOLE-6-CARBOXYLATE
METHYL3-IODO-1H-INDAZOLE-6-CARBOXYLATE
PS-7125

MDL Number

MFCD07781616

FAQ

What is Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1)?

Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) is an organic compound with the molecular formula C11H9INO2. It is a white or light yellow solid with a characteristic odor. This compound is known for its potential use in pharmaceutical research and synthesis of other chemical compounds.

What are the main uses of Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1)?

Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) is primarily used in pharmaceutical research, particularly in the development of new drugs. It serves as a valuable intermediate in the synthesis of various chemical entities and has potential applications in the development of antiviral and antifungal agents.

Is Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) safe?

Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) is generally safe when handled under proper conditions. However, it is important to follow safety guidelines, including the use of personal protective equipment (PPE) and proper ventilation. Exposure to the compound should be minimized to avoid inhalation or skin contact, which could lead to irritation or other health effects.

How should Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) be stored?

Methyl 3-iodo-1H-indazole-6-carboxylate (CAS: 885518-82-1) should be stored in a cool, dry place away from direct sunlight and sources of heat. It should be kept in a tightly closed container to prevent exposure to moisture and light. The storage area should be well-ventilated to minimize the risk of fire or explosion. Keep the substance away from flammable materials and incompatible substances such as reductants and organic compounds.