3,5-Dimethyl-4-iodopyrazole

• CAS: 2033-45-6
• Catalog Number: ACM2033456
• Category: Other
• Molecular Weight: 222.03
• Molecular Formula: C₅H₇IN₂
• Synonyms: NCIOpen2_006773, 3,5-Dimethyl-4-iodopyrazole, 683523_ALDRICH, Pyrazole, 3,5-dimethyl-4-iodo-, 3,5-Dimethyl-4-iodo-1H-pyrazole, BM150, 4-iodo-3,5-dimethyl-1H-pyrazole, NSC 100887, ALBB-000005, CID97115, BRN 0108535, NSC100887, ZINC00157367, LS-128479, ST5307820, 5-23-05-00159 (Beilstein Handbook Reference), 2033-45-6
• IUPAC Name: 4-iodo-3,5-dimethyl-1H-pyrazole
• Canonical SMILES: CC1=C(C(=NN1)C)I
• InChI Key: MZZXIXHKDJNBJQ-UHFFFAOYSA-N
• Boiling Point: 297.3ºC at 760 mmHg
• Melting Point: 136-140ºC
• Flash Point: 133.6ºC
• Density: 1.92 g/cm³
• Appearance: pale white crystal powder
• Exact Mass: 221.96500
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Safety Description: S24/25

Custom Q&A

What is the molecular formula of 3,5-Dimethyl-4-iodopyrazole?

The molecular formula of 3,5-Dimethyl-4-iodopyrazole is C5H7IN2.

What is the molecular weight of 3,5-Dimethyl-4-iodopyrazole?

The molecular weight of 3,5-Dimethyl-4-iodopyrazole is 222.03 g/mol.

What is the IUPAC name of 3,5-Dimethyl-4-iodopyrazole?

The IUPAC name of 3,5-Dimethyl-4-iodopyrazole is 4-iodo-3,5-dimethyl-1H-pyrazole.

What is the InChI of 3,5-Dimethyl-4-iodopyrazole?

The InChI of 3,5-Dimethyl-4-iodopyrazole is InChI=1S/C5H7IN2/c1-3-5(6)4(2)8-7-3/h1-2H3,(H,7,8).

What is the Canonical SMILES of 3,5-Dimethyl-4-iodopyrazole?

The Canonical SMILES of 3,5-Dimethyl-4-iodopyrazole is CC1=C(C(=NN1)C)I.

What is the CAS number of 3,5-Dimethyl-4-iodopyrazole?

The CAS number of 3,5-Dimethyl-4-iodopyrazole is 2033-45-6.

What is the European Community (EC) number of 3,5-Dimethyl-4-iodopyrazole?

The European Community (EC) number of 3,5-Dimethyl-4-iodopyrazole is 622-388-6.

What is the ChEMBL ID of 3,5-Dimethyl-4-iodopyrazole?

The ChEMBL ID of 3,5-Dimethyl-4-iodopyrazole is CHEMBL5192672.

What is the XLogP3-AA value of 3,5-Dimethyl-4-iodopyrazole?

The XLogP3-AA value of 3,5-Dimethyl-4-iodopyrazole is 1.7.

Is 3,5-Dimethyl-4-iodopyrazole a covalently-bonded unit?

Yes, 3,5-Dimethyl-4-iodopyrazole is a covalently-bonded unit.