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Structure

6-Bromo-1H-indazole-3-carbaldehyde

CAS
885271-72-7
Catalog Number
ACM885271727
Category
Bromine Series
Molecular Weight
225.0443
Molecular Formula
C8H5BrN2O

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Specification

Synonyms
6-BROMO-1H-INDAZOLE-3-CARBALDEHYDE, 885271-72-7, 6-Bromo-1H-indazole-3-carboxaldehyde, 6-Bromo-indazole-3-carboxaldehyde, AG-H-56967, PubChem7806, ACMC-209qu3, KSC495S9H, 6-bromo-indazole-3-carbaldehyde, CTK3J5993, MolPort-003-984-034, ANW-39049, SBB067552, WTI-11215, ZINC14909848, 6-BROMOINDAZOLE-3-CARBALDEHYDE, AKOS015898367, AB26802, LS40015, RP27494
IUPAC Name
6-bromo-2H-indazole-3-carbaldehyde
Canonical SMILES
C1=CC2=C(NN=C2C=C1Br)C=O
InChI Key
RQQKGUPOPZJRLE-UHFFFAOYSA-N
Boiling Point
414.1ºC at 760 mmHg
Density
1.83 g/cm³
Exact Mass
223.95900
H-Bond Acceptor
2
H-Bond Donor
1
MDL Number
MFCD06738286
Size
250mg,500mg,1g,5g,25g,100g
What is the molecular formula of 6-Bromo-1H-indazole-3-carbaldehyde?

The molecular formula is C8H5BrN2O.

When was 6-Bromo-1H-indazole-3-carbaldehyde first created?

It was first created on February 29, 2008.

What is the molecular weight of 6-Bromo-1H-indazole-3-carbaldehyde?

The molecular weight is 225.04 g/mol.

What is the IUPAC name of 6-Bromo-1H-indazole-3-carbaldehyde?

The IUPAC name is 6-bromo-2H-indazole-3-carbaldehyde.

What is the InChIKey of 6-Bromo-1H-indazole-3-carbaldehyde?

The InChIKey is RQQKGUPOPZJRLE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 6-Bromo-1H-indazole-3-carbaldehyde have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of 6-Bromo-1H-indazole-3-carbaldehyde?

The topological polar surface area is 45.8Ų.

Is 6-Bromo-1H-indazole-3-carbaldehyde a canonicalized compound?

Yes, it is a canonicalized compound.

How many rotatable bond counts does 6-Bromo-1H-indazole-3-carbaldehyde have?

It has 1 rotatable bond count.

What is the CAS number of 6-Bromo-1H-indazole-3-carbaldehyde?

The CAS number is 885271-72-7.

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