5-BROMO-3-PHENYL-2,1-BENZISOXAZOLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H8BrNO
Molecular Weight	274.113
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-BROMO-3-PHENYL-2,1-BENZISOXAZOLE

Structure Search

SMILES

BrC1=CC2=C(ON=C2C=C1)C3=CC=CC=C3

InChI

InChIKey=HKEVIXPPTCEYEW-UHFFFAOYSA-N

InChI=1S/C13H8BrNO/c14-10-6-7-12-11(8-10)13(16-15-12)9-4-2-1-3-5-9/h1-8H

HIDE SMILES / InChI

Molecular Formula	C13H8BrNO
Molecular Weight	274.113
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:56:39 GMT 2025` Edited by `admin` on `Tue Apr 01 19:56:39 GMT 2025`
Record UNII	292AUJ3WRQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-405895

Preferred Name

English

5-BROMO-3-PHENYL-2,1-BENZISOXAZOLE

Systematic Name

English

3-PHENYL-5-BROMO-2,1-BENZISOXAZOLE

Systematic Name

English

5-BROMO-3-PHENYLANTHRANIL

Systematic Name

English

2,1-BENZISOXAZOLE, 5-BROMO-3-PHENYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

292AUJ3WRQ

Created by admin on Tue Apr 01 19:56:39 GMT 2025 , Edited by admin on Tue Apr 01 19:56:39 GMT 2025

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CAS

885-34-7

Created by admin on Tue Apr 01 19:56:39 GMT 2025 , Edited by admin on Tue Apr 01 19:56:39 GMT 2025

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NSC

405895

Created by admin on Tue Apr 01 19:56:39 GMT 2025 , Edited by admin on Tue Apr 01 19:56:39 GMT 2025

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EPA CompTox

DTXSID10237082

Created by admin on Tue Apr 01 19:56:39 GMT 2025 , Edited by admin on Tue Apr 01 19:56:39 GMT 2025

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PUBCHEM

347290

Created by admin on Tue Apr 01 19:56:39 GMT 2025 , Edited by admin on Tue Apr 01 19:56:39 GMT 2025

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