Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: Indene
CAS No.: 95-13-6
Molecular formula: C9H8
Molecular weight: 116.16 g/mol
SMILES: C1C=CC2=CC=CC=C21
Structural class:
Other identifiers:

indene

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 250mg 用于环境分析,GC≥99% 312 -20℃ in stock -
Kehua Intelligence 25ml 95% 44 -20℃ in stock -
Kehua Intelligence 100ml 95% 136 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

1H-indene


4.2 InChI

InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2


4.3 InChIKey

YBYIRNPNPLQARY-UHFFFAOYSA-N


4.4 Canonical SMILES

C1C=CC2=CC=CC=C21


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon