CAS No.: 25249-16-5 — 2-Hydroxyethyl 2,2-dimethylbutanoate (聚甲基丙烯酸 2-羟乙酯)

1. Primary Information

English name:	2-Hydroxyethyl 2,2-dimethylbutanoate
CAS No.:	25249-16-5
Molecular formula:	C₈H₁₆O₃
Molecular weight:	160.21 g/mol
SMILES:	CCC(C)(C)C(=O)OCCO
Structural class:
Other identifiers:	Gel, Glycol Methacrylate Gel, Hydroxymethacrylate Glycol Methacrylate Gel Hydroxymethacrylate Gel Methacrylate Gel, Glycol

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	2.5g	average Mv ~1,000,000	720	RT	in stock	-
Kehua Intelligence	2.5g	averageMv~300,000	720	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 27 26 0 0 0 0 0 0 0999 V2000 0.8765 0.0753 0.0175 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3536 -0.4590 1.8862 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4428 -0.4183 -0.9969 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4369 -0.4138 -0.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 0.9217 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0751 -1.5015 -1.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6945 -0.8726 0.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2673 -0.2747 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0506 2.0985 -0.1417 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 0.2290 0.8334 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2148 0.6155 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5118 0.7858 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8123 1.2008 -1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9138 -1.7010 -2.0098 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2174 -1.2084 -1.9493 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8105 -2.4423 -0.8367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5602 -0.9361 -0.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5453 -1.8627 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9491 -0.1918 1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2664 2.2888 0.5969 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 1.9328 0.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1672 3.0058 -0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8655 1.0075 1.5836 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 -0.7261 1.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1206 0.7536 0.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9958 1.5347 -0.5991 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1969 -0.1407 -1.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 8 2 0 0 0 0 3 11 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-hydroxyethyl 2,2-dimethylbutanoate

4.2 InChI

InChI=1S/C8H16O3/c1-4-8(2,3)7(10)11-6-5-9/h9H,4-6H2,1-3H3

4.3 InChIKey

CRUFITZJZGASJI-UHFFFAOYSA-N

4.4 Canonical SMILES

CCC(C)(C)C(=O)OCCO

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)