CAS No.: 111-96-6 — Diglyme (二乙二醇二甲醚)

1. Primary Information

English name:	Diglyme
CAS No.:	111-96-6
Molecular formula:	C₆H₁₄O₃
Molecular weight:	134.17 g/mol
SMILES:	COCCOCCOC
Structural class:
Other identifiers:	bis(2-methoxyethyl)ether DGDME diethylene glycol dimethyl ether diglyme

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	99%	240	RT	in stock	-
Kehua Intelligence	5ml	99%	720	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 23 22 0 0 0 0 0 0 0999 V2000 -0.0007 0.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5667 -0.4091 0.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5664 -0.4091 -0.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1752 -0.5153 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1749 -0.5146 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3909 0.3912 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3909 0.3915 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 0.3903 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7409 0.3899 0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1932 -1.1618 0.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.1627 -0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1934 -1.1612 -0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 -1.1623 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.0488 0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3798 1.0277 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3692 1.0491 -0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 1.0280 0.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6097 -0.2732 0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7796 1.0410 0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7791 0.9896 -0.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7794 0.9892 0.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6095 -0.2738 -0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7797 1.0407 -0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 7 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 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

1-methoxy-2-(2-methoxyethoxy)ethane

4.2 InChI

InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3

4.3 InChIKey

SBZXBUIDTXKZTM-UHFFFAOYSA-N

4.4 Canonical SMILES

COCCOCCOC

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)