1H-Pyrrole-2-carboxaldehyde,4,5-dibromo-

CAS
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CAS
932-82-1
Size
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Purity
98%
Price
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Availability
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Catalog Number

ACM932821

Product Name

1H-Pyrrole-2-carboxaldehyde,4,5-dibromo-

Structure

Structure

CAS

932-82-1

Category

Heterocyclic Organic Compound

Synonyms

MolPort-001-769-303, ZINC04368866, OR5763, CID7213145, 932-82-1

IUPAC Name

4,5-dibromo-1H-pyrrole-2-carbaldehyde

Molecular Weight

252.8914

Molecular Formula

C₅H₃Br₂NO

Canonical SMILES

C1=C(NC(=C1Br)Br)C=O

InChI Key

IJBMHOCPMBSRPX-UHFFFAOYSA-N

Boiling Point

341.9ºC at 760 mmHg

Melting Point

144-148ºC

Flash Point

160.6ºC

Density

2.262 g/cm³

Exact Mass

250.85800

Hazard Statements

Xi

H-Bond Acceptor

1

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The molecular formula is C5H3Br2NO.

What is the IUPAC name of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The IUPAC name is 4,5-dibromo-1H-pyrrole-2-carbaldehyde.

What is the InChI of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The InChI is InChI=1S/C5H3Br2NO/c6-4-1-3(2-9)8-5(4)7/h1-2,8H.

What is the InChIKey of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The InChIKey is IJBMHOCPMBSRPX-UHFFFAOYSA-N.

What is the canonical SMILES of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The canonical SMILES is C1=C(NC(=C1Br)Br)C=O.

What is the molecular weight of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The molecular weight is 252.89 g/mol.

What is the CAS number of 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo?

The CAS number is 932-82-1.

How many hydrogen bond donor count does 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor count does 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo have?

It has 1 hydrogen bond acceptor count.

How many rotatable bond count does 1H-Pyrrole-2-carboxaldehyde,4,5-dibromo have?

It has 1 rotatable bond count.

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