CAS No.: 294-62-2 — Cyclododecane (环十二烷)

1. Primary Information

English name:	Cyclododecane
CAS No.:	294-62-2
Molecular formula:	C₁₂H₂₄
Molecular weight:	168.32 g/mol
SMILES:	C1CCCCCCCCCCC1
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	250mg	98%	416	RT	in stock	-
Kehua Intelligence	5g	99%	55	RT	in stock	-
Kehua Intelligence	25g	99%	140	RT	in stock	-
Kehua Intelligence	100g	99%	424	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 36 36 0 0 0 0 0 0 0999 V2000 -0.2460 -1.7711 0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5163 -1.7078 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9988 -2.0502 -0.5245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7051 -1.0643 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3202 -1.6780 0.1671 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5216 0.3619 0.7387 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4393 -0.2232 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2066 1.4598 -0.2885 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3052 0.8287 -0.4581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7386 1.6254 -0.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6749 2.1495 0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1958 2.0693 0.4262 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3516 -2.5461 1.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1262 -0.8311 0.8555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7927 -2.7282 -0.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3363 -1.1709 -1.4657 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9337 -1.5203 -1.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0219 -3.1173 -0.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9922 -1.7117 1.0286 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5602 -1.0646 -0.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -1.8899 -0.5244 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4621 -2.3396 1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8007 0.3683 1.5607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4798 0.6314 1.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4254 -0.1007 1.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7256 -0.0500 1.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 2.4182 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8127 1.2921 -1.1872 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 0.4498 -1.3202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3119 1.0468 -0.8381 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6968 2.3834 -1.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3822 0.7032 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7692 2.8829 -0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 2.5429 0.8526 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0991 1.4138 1.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1175 3.0646 0.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

cyclododecane

4.2 InChI

InChI=1S/C12H24/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-12H2

4.3 InChIKey

DDTBPAQBQHZRDW-UHFFFAOYSA-N

4.4 Canonical SMILES

C1CCCCCCCCCCC1

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)