3-Bromobenzaldoxime

CAS
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Purity
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CAS
51873-95-1
Size
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Purity
96%
Price
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Availability
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Catalog Number

ACM51873951

Product Name

3-Bromobenzaldoxime

Structure

Structure

CAS

51873-95-1

Category

Heterocyclic Organic Compound

Synonyms

3-Bromobenzaldoxime, (E)-3-bromobenzaldehyde oxime, 3-Bromobenzaldehyde oxime, 51873-95-1, PubChem3732, AC1NT9N0, AKOS B004043, MolPort-010-999-351, AKOS000304359, AB03839, AS00916, FT-0615194, LT00454796, (NE)-N-[(3-bromophenyl)methylidene]hydroxylamine, I01-5441

IUPAC Name

(NE)-N-[(3-bromophenyl)methylidene]hydroxylamine

Molecular Weight

200.03

Molecular Formula

C₇H₆BrNO

Canonical SMILES

C1=CC(=CC(=C1)Br)C=NO

InChI Key

DBGBMIPNNIZQNN-WEVVVXLNSA-N

Boiling Point

266.7ºC at 760mmHg

Melting Point

73-76ºC

Flash Point

115.1ºC

Density

1.52g/cm³

EC Number

610-748-5

Exact Mass

198.96300

Hazard Statements

Xi,Xn

H-Bond Acceptor

2

H-Bond Donor

1

Safety Description

S26-S36

MSDS

COA

Spec Sheet

Download Spec Sheet

May 23, 2023

A useful ligand molecule.

The binuclear complex synthesized by coordination of 3-Bromobenzaldoxime with rare earth metals has diamagnetic effect.

What is the PubChem CID of 3-Bromobenzaldoxime?

The PubChem CID of 3-Bromobenzaldoxime is 5375574.

What is the molecular formula of 3-Bromobenzaldoxime?

The molecular formula of 3-Bromobenzaldoxime is C7H6BrNO.

What is the molecular weight of 3-Bromobenzaldoxime?

The molecular weight of 3-Bromobenzaldoxime is 200.03 g/mol.

What is the IUPAC name of 3-Bromobenzaldoxime?

The IUPAC name of 3-Bromobenzaldoxime is (NE)-N-[(3-bromophenyl)methylidene]hydroxylamine.

What is the InChI of 3-Bromobenzaldoxime?

The InChI of 3-Bromobenzaldoxime is InChI=1S/C7H6BrNO/c8-7-3-1-2-6(4-7)5-9-10/h1-5,10H/b9-5+.

What is the InChIKey of 3-Bromobenzaldoxime?

The InChIKey of 3-Bromobenzaldoxime is DBGBMIPNNIZQNN-WEVVVXLNSA-N.

What are the synonyms of 3-Bromobenzaldoxime?

The synonyms of 3-Bromobenzaldoxime include 3-Bromobenzaldehyde oxime, 51873-95-1, 32605-62-2, and 52739-46-5.

What is the XLogP3-AA value of 3-Bromobenzaldoxime?

The XLogP3-AA value of 3-Bromobenzaldoxime is 2.3.

How many hydrogen bond donor counts does 3-Bromobenzaldoxime have?

3-Bromobenzaldoxime has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 3-Bromobenzaldoxime have?

3-Bromobenzaldoxime has 2 hydrogen bond acceptor counts.

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