Diethylamine Acetate

CAT: 0127-OR1079331Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1079331Size:25 g

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CAS Number

20726-63-0

MDL Number

MFCD00060243

Purity

>97.0%

Smiles

CCNCC.CC (=O) O

Chemical Information

Diethylamine acetate

CAS Number	20726-63-0
PubChem CID	167925
IUPAC Name	acetic acid;N-ethylethanamine
Molecular Formula	C6H15NO2
Molecular Weight	133.19
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	42

SMILES

CCNCC.CC(=O)O

InChI

InChI=1S/C4H11N.C2H4O2/c1-3-5-4-2;1-2(3)4/h5H,3-4H2,1-2H3;1H3,(H,3,4)

InChIKey

UEHUZQKLOWYOMO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20726-63-0

CID: 167925

Formula: C6H15NO2

MW: 133.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	133.19
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	133.110278721
Monoisotopic Mass	133.110278721
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	42.1
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	2
Compound Is Canonicalized	Yes

Catalog	Name
OR62142-01	[Bis (diethylamino) phosphanyl]diethylamine
OR97901	Diethylamine
OR1012881	Diethylamine Hydrobromide
PC408128-01	(Trifluoromethyl) diethylamine
OR1030802-01	Diethylamine Salicylate
OR925271-01	Diethylamine hydrochloride
OR1095864	(3-Bromobenzyl) -diethylamine
OR1092494	(4-Bromobenzyl) -diethylamine
BUP21400-01	Diethylamine NONOate diethylammonium salt
OR1083409	(2,6-Bromobenzyl) -diethylamine

Catalog	Name
sc-487065	Diethylamine Acetate
DC3320	Diethylamine
M24671-01	Diethylamine hydrochloride
EAA41992	Diethylamine salicylate
HY-15036A-01	Diclofenac (diethylamine)
271153-01	Diclofenac diethylamine
D443493	Diethylamine-d11
sc-327915	Hexafluoropropene diethylamine