1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde

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CAS
647824-51-9
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Purity
96%
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Catalog Number

ACM647824519

Product Name

1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde

Structure

Structure

CAS

647824-51-9

Category

Heterocyclic Organic Compound

Synonyms

647824-51-9, 1-Tert-Butyl-3,5-Dimethyl-1H-Pyrazole-4-Carbaldehyde, ST50825157, 1-tert-butyl-3,5-dimethylpyrazole-4-carbaldehyde, 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde, 1-(tert-butyl)-3,5-dimethylpyrazole-4-carbaldehyde, ZINC00159400, ACMC-20ap9c, AC1MCRC5, AC1Q2PJM, CTK5C1703, MolPort-000-144-209, SBB079138, AKOS000192095, AG-G-43350, MCULE-7881398808, KB-86566, I14-85820, 1-(tert-Butyl)-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde

IUPAC Name

1-tert-butyl-3,5-dimethylpyrazole-4-carbaldehyde

Molecular Weight

180.25

Molecular Formula

C₁₀H₁₆N₂O

InChI Key

WQHXOHHEPNBXMF-UHFFFAOYSA-N

Boiling Point

273.2ºC at 760 mmHg

Melting Point

56ºC

Flash Point

119ºC

Density

1g/cm³

Exact Mass

180.12600

H-Bond Acceptor

2

H-Bond Donor

0

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

The molecular formula is C10H16N2O.

What are some synonyms for 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

Some synonyms are 647824-51-9, 1-(tert-butyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde, and 1-tert-butyl-3,5-dimethylpyrazole-4-carbaldehyde.

When was 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde first created in PubChem?

It was first created on July 19, 2005.

What is the InChIKey of 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

The InChIKey is WQHXOHHEPNBXMF-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde have?

It has 2 hydrogen bond acceptors.

What is the exact mass of 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

The exact mass is 180.126263138 g/mol.

Is 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde a canonicalized compound in PubChem?

Yes, it is a canonicalized compound.

How many rotatable bonds does 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde have?

It has 2 rotatable bonds.

What is the topological polar surface area of 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

The topological polar surface area is 34.9 Å^2.

How many heavy atoms are present in 1-tert-Butyl-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde?

There are 13 heavy atoms in the compound.

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