3-(1,1-Dimethylethyl) 7-borono-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

CAS Registry Number®

720692-77-3

CAS Name

3-(1,1-Dimethylethyl) 7-borono-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

Molecular Formula

C15H22BNO4

Molecular Mass

291.15

Cite this Page

3-(1,1-Dimethylethyl) 7-borono-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=720692-77-3 (retrieved 2024-12-03) (CAS RN: 720692-77-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H22BNO4/c1-15(2,3)21-14(18)17-8-6-11-4-5-13(16(19)20)10-12(11)7-9-17/h4-5,10,19-20H,6-9H2,1-3H3

InChIKey

InChIKey=POZYCYGOSOMMJH-UHFFFAOYSA-N

SMILES

B(O)(O)C=1C=C2C(CCN(C(OC(C)(C)C)=O)CC2)=CC1

Canonical SMILES

O=C(OC(C)(C)C)N1CCC2=CC=C(C=C2CC1)B(O)O

Other Names for this Substance

  • 3H-3-Benzazepine-3-carboxylic acid, 7-borono-1,2,4,5-tetrahydro-, 3-(1,1-dimethylethyl) ester
  • 3-(1,1-Dimethylethyl) 7-borono-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate
  • [3-[[(1,1-Dimethylethyl)oxy]carbonyl]-2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl]boronic acid

CAS INSIGHTSTM
Hourglass and a clock