Diethylene Glycol 99% AR

CAT: 1507-98900500Size: 500 mLDry Ice: NoHazardous: No

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CAT#:1507-98900500Size:500 mL

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CAS Number

111-46-6

HSN Code

29094100

Chemical Information

Diethylene Glycol

Diethylene glycol is a hydroxyether.

CAS Number	111-46-6
PubChem CID	8117
IUPAC Name	2-(2-hydroxyethoxy)ethanol
Molecular Formula	C4H10O3
Molecular Weight	106.12
XLogP	-1.3
Topological Polar Surface Area	49.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	7
Formal Charge	0
Complexity	26

SMILES

C(COCCO)O

InChI

InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

InChIKey

MTHSVFCYNBDYFN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 111-46-6

CID: 8117

Formula: C4H10O3

MW: 106.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	106.12
XLogP3	-1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	106.062994177
Monoisotopic Mass	106.062994177
Topological Polar Surface Area	49.7 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	26.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
0989B 00500	Diethylene Glycol 99.5% GC
00996 00100	Diethylene Triamine Penta Acetic Acid 99% AR
99600100	Diethylene Triamine Penta Acetic Acid 99% AR
00996 00500	Diethylene Triamine Penta Acetic Acid 99% AR
99600500	Diethylene Triamine Penta Acetic Acid 99% AR
01174 02500	Ethanediol 99.5% AR (Ethylene glycol)
117402500	Ethanediol 99.5% AR (Ethylene Glycol)
117400500	Ethanediol 99.5% AR (Ethylene Glycol)
01174 00500	Ethanediol 99.5% AR (Ethylene glycol)
98800500	Diethylene Glycol 98.5% For Synthesis

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