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Details

Stereochemistry ACHIRAL
Molecular Formula C14H10BNO3
Molecular Weight 251.045
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[(1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-yl)oxy]benzonitrile

SMILES

OB1OCC2=CC(OC3=C(C=CC=C3)C#N)=CC=C12

InChI

InChIKey=GWZBDMXSRRGGLN-UHFFFAOYSA-N
InChI=1S/C14H10BNO3/c16-8-10-3-1-2-4-14(10)19-12-5-6-13-11(7-12)9-18-15(13)17/h1-7,17H,9H2

HIDE SMILES / InChI

Molecular Formula C14H10BNO3
Molecular Weight 251.045
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 Sat Dec 16 19:17:29 GMT 2023
Edited
by admin
on Sat Dec 16 19:17:29 GMT 2023
Record UNII
YH46QL7QQN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[(1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-yl)oxy]benzonitrile
Systematic Name English
Benzonitrile, 2-[(1,3-dihydro-1-hydroxy-2,1-benzoxaborol-5-yl)oxy]-
Systematic Name English
Crisaborole o-isomer
Common Name English
4-Descyano-2-cyano-crisaborole
Systematic Name English
2-[(1-Hydroxy-1,3-dihydro-2,1-benzoxaborol-5-yl)oxy]benzonitrile
Systematic Name English
Code System Code Type Description
PUBCHEM
44223606
Created by admin on Sat Dec 16 19:17:29 GMT 2023 , Edited by admin on Sat Dec 16 19:17:29 GMT 2023
PRIMARY
CAS
906673-30-1
Created by admin on Sat Dec 16 19:17:29 GMT 2023 , Edited by admin on Sat Dec 16 19:17:29 GMT 2023
PRIMARY
FDA UNII
YH46QL7QQN
Created by admin on Sat Dec 16 19:17:29 GMT 2023 , Edited by admin on Sat Dec 16 19:17:29 GMT 2023
PRIMARY