4-Bromo-benzooxazole-2-carboxylic acid amide

CAS
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CAS
954239-82-8
Size
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Purity
97%
Price
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Availability
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Catalog Number

ACM954239828

Product Name

4-Bromo-benzooxazole-2-carboxylic acid amide

Structure

Structure

CAS

954239-82-8

Category

Heterocyclic Organic Compound

Synonyms

954239-82-8, DB-080263, 4-Bromo-benzooxazole-2-carboxylic acid amide, 4-BROMO-BENZOOXAZOLE-2-CARBOXYLICACIDAMIDE

IUPAC Name

4-bromo-1,3-benzoxazole-2-carboxamide

Molecular Weight

241.0437

Molecular Formula

C8H5BrN2O2

Canonical SMILES

C1=CC2=C(C(=C1)Br)N=C(O2)C(=O)N

InChI Key

JJGRBARWZGIZLH-UHFFFAOYSA-N

H-Bond Acceptor

3

H-Bond Donor

1

MDL Number

MFCD09832209

Size

500mg,1g,5g

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 4-Bromo-benzooxazole-2-carboxylic acid amide?

The molecular formula is C8H5BrN2O2.

What is the synonym for 4-Bromo-benzooxazole-2-carboxylic acid amide?

One synonym is 4-Bromobenzo[d]oxazole-2-carboxamide.

What is the IUPAC name of 4-Bromo-benzooxazole-2-carboxylic acid amide?

The IUPAC name is 4-bromo-1,3-benzoxazole-2-carboxamide.

What is the InChI code for 4-Bromo-benzooxazole-2-carboxylic acid amide?

The InChI code is InChI=1S/C8H5BrN2O2/c9-4-2-1-3-5-6(4)11-8(13-5)7(10)12/h1-3H,(H2,10,12).

What is the InChIKey for 4-Bromo-benzooxazole-2-carboxylic acid amide?

The InChIKey is JJGRBARWZGIZLH-UHFFFAOYSA-N.

What is the canonical SMILES representation of 4-Bromo-benzooxazole-2-carboxylic acid amide?

The canonical SMILES representation is C1=CC2=C(C(=C1)Br)N=C(O2)C(=O)N.

What is the molecular weight of 4-Bromo-benzooxazole-2-carboxylic acid amide?

The molecular weight is 241.04 g/mol.

What is the XLogP3-AA value of 4-Bromo-benzooxazole-2-carboxylic acid amide?

The XLogP3-AA value is 1.7.

How many hydrogen bond donor counts does 4-Bromo-benzooxazole-2-carboxylic acid amide have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 4-Bromo-benzooxazole-2-carboxylic acid amide have?

It has 3 hydrogen bond acceptor counts.

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