CAS No.: 3777-69-3 — 2-Pentylfuran (2-戊基呋喃)

1. Primary Information

English name:	2-Pentylfuran
CAS No.:	3777-69-3
Molecular formula:	C₉H₁₄O
Molecular weight:	138.21 g/mol
SMILES:	CCCCCC1=CC=CO1
Structural class:
Other identifiers:	2-pentylfuran

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	5ml	GC≥99%	417	2-8°C	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 24 24 0 0 0 0 0 0 0999 V2000 -1.5128 -0.1364 -1.0343 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1262 -1.2907 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.0888 0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2117 -1.6097 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1814 0.1764 -0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2347 -0.5086 0.2247 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 1.3443 0.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 0.1821 1.1507 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7324 1.0824 0.4077 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4409 0.8491 -0.9162 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.1065 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7718 -2.1743 -0.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2167 0.8081 0.2173 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0072 -0.2769 1.3631 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0423 -1.8306 1.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6314 -2.5182 -0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0177 0.3913 -1.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8133 -0.7176 -0.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1234 1.1455 1.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8689 1.5169 -0.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3233 2.2630 0.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8886 0.0727 2.2246 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4337 1.8103 0.7892 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 1.2770 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 8 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-pentylfuran

4.2 InChI

InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3

4.3 InChIKey

YVBAUDVGOFCUSG-UHFFFAOYSA-N

4.4 Canonical SMILES

CCCCCC1=CC=CO1

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

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)