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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H9BrO2
Molecular Weight 229.071
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-BROMOMETHYL-1,4-BENZODIOXANE, (R)-

SMILES

BrC[C@H]1COC2=CC=CC=C2O1

InChI

InChIKey=QYLFKNVZIFTCIY-ZETCQYMHSA-N
InChI=1S/C9H9BrO2/c10-5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7H,5-6H2/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H9BrO2
Molecular Weight 229.071
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:35:04 GMT 2023
Edited
by admin
on Sat Dec 16 18:35:04 GMT 2023
Record UNII
TN52H68P6D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-BROMOMETHYL-1,4-BENZODIOXANE, (R)-
Systematic Name English
(R)-2-(BROMOMETHYL)-2,3-DIHYDROBENZO(B)(1,4)DIOXINE
Systematic Name English
(-)-2-BROMOMETHYL-1,4-BENZODIOXANE
Systematic Name English
1,4-BENZODIOXIN, 2-(BROMOMETHYL)-2,3-DIHYDRO-, (2R)-
Systematic Name English
(3R)-3-(BROMOMETHYL)-2,3-DIHYDRO-1,4-BENZODIOXINE
Systematic Name English
Code System Code Type Description
FDA UNII
TN52H68P6D
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
PUBCHEM
6932008
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
CAS
1142953-55-6
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER