B-[3-[[(Ethylamino)thioxomethyl]amino]phenyl]boronic acid

CAS Registry Number®

1072946-06-5
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CAS Name

B-[3-[[(Ethylamino)thioxomethyl]amino]phenyl]boronic acid

Molecular Formula

C9H13BN2O2S

Molecular Mass

224.09

Cite this Page

B-[3-[[(Ethylamino)thioxomethyl]amino]phenyl]boronic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1072946-06-5 (retrieved 2024-04-29) (CAS RN: 1072946-06-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H13BN2O2S/c1-2-11-9(15)12-8-5-3-4-7(6-8)10(13)14/h3-6,13-14H,2H2,1H3,(H2,11,12,15)

InChIKey

InChIKey=XBGBWHPPZYSGNM-UHFFFAOYSA-N

SMILES

N(C(NCC)=S)C1=CC(B(O)O)=CC=C1

Canonical SMILES

S=C(NC1=CC=CC(=C1)B(O)O)NCC

Other Names for this Substance

  • Boronic acid, B-[3-[[(ethylamino)thioxomethyl]amino]phenyl]-
  • B-[3-[[(Ethylamino)thioxomethyl]amino]phenyl]boronic acid

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