# 5-溴-4-己基-2-噻吩硼酸MIDA酯 (CAS 1416241-98-9)

CAS: 1416241-98-9
PubChem CID: 139044685
InChIKey: LUTGFBKAKLMBHD-UHFFFAOYSA-N
Molecular formula: C15H21BBrNO4S
Molar mass: 402.1 g/mol
IUPAC: 1-(5-bromo-4-hexylthiophen-2-yl)-5-methyl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione
SMILES: [B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=CC(=C(S3)Br)CCCCCC
InChI: InChI=1S/C15H21BBrNO4S/c1-3-4-5-6-7-11-8-12(23-15(11)17)16-18(2,9-13(19)21-16)10-14(20)22-16/h8H,3-7,9-10H2,1-2H3
PSA: 80.8 A^2
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 23

## About the compound

5-溴-4-己基-2-噻吩硼酸MIDA酯 (CAS 1416241-98-9) is a chemical compound registered under CAS number 1416241-98-9. Molecular formula: C15H21BBrNO4S. Molar mass: 402.1 g/mol. The full systematic IUPAC name is: 1-(5-bromo-4-hexylthiophen-2-yl)-5-methyl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione. 
Chemical data comes from the PubChem (NIH), ChEMBL (EBI) and NIST WebBook databases. GHS statement translations comply with the CLP Regulation (EC 1272/2008). Interactive 3D model and 2D skeleton available at: https://molgod.org/molekula/1416241-98-9/


## Available in the shop

Shop: MolGod
Product: 5-溴-4-己基-2-噻吩硼酸MIDA酯 (CAS 1416241-98-9) — Shanghai Wanna Polymer
URL: https://molgod.org/sds-cards/5-%e6%ba%b4-4-%e5%b7%b1%e5%9f%ba-2-%e5%99%bb%e5%90%a9%e7%a1%bc%e9%85%b8mida%e9%85%af-cas-1416241-98-9-shanghai-wanna-polymer/

## Data sources

  - PubChem CID 139044685: https://pubchem.ncbi.nlm.nih.gov/compound/139044685
  - NIST WebBook: https://webbook.nist.gov/cgi/cbook.cgi?ID=1416241-98-9
  - ChEMBL: https://www.ebi.ac.uk/chembl/g/#search_results/all/query=1416241-98-9

---
Standalone HTML page: https://molgod.org/molekula/1416241-98-9/
Markdown version: https://molgod.org/molekula/1416241-98-9.md
JSON API: https://molgod.org/wp-json/molgod/v1/molecule/1416241-98-9
Last updated: 2026-09-02
Generator: MOL-GOD v3.12.33