N-Acetylethylenimine

CAT: 0024-sc-212107Size: 1 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-212107Size:1 mL

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CAS Number

460-07-1

Chemical Information

Acetylethylenimine

CAS Number	460-07-1
PubChem CID	9994
IUPAC Name	1-(aziridin-1-yl)ethanone
Molecular Formula	C4H7NO
Molecular Weight	85.10
XLogP	-0.5
Topological Polar Surface Area	20.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	6
Formal Charge	0
Complexity	75

SMILES

CC(=O)N1CC1

InChI

InChI=1S/C4H7NO/c1-4(6)5-2-3-5/h2-3H2,1H3

InChIKey

OTIXUSNHAKOJBX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 460-07-1

CID: 9994

Formula: C4H7NO

MW: 85.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	85.10
XLogP3	-0.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	85.052763847
Monoisotopic Mass	85.052763847
Topological Polar Surface Area	20.1 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	75.6
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
sc-222018B	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
sc-222018A	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
sc-222018	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
sc-255378	N, N, N', N'', N''-Pentamethyldiethylenetriamine
sc-255378A	N, N, N', N'', N''-Pentamethyldiethylenetriamine
sc-476472	N, N, N', N'-Tetramethylmalonamide
sc-475571	N, N, N', N'-Tetrapentylmalonamide
sc-475567	N, N, N', N'-Tetraethylmalonamide
sc-253153	N, N, N', N'-Tetramethyldiaminomethane
sc-228780	N, N, N', N'-Tetraethyldiethylenetriamine

Catalog	Name
MBS6090001-01	N-Acetylethylenimine (30% benzene)
TRC-A174002-10ML	N-Acetylethylenimine, contains ~40% Cyclohexane
A174000	N-Acetylethylenimine, contains ~40% Benzene
OH153454-01	N, N', N'', N''', N'''', N''''', N''''''-Heptaacetylchitoheptaose
FH171463-01	N, N, N', N', N'', N''-Hexamethoxymethylmelamine
OR9122-01	N, N, N', N', N'', N''-Hexamethylmethanetriamine
297193-01	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
TRC-H290750-10MG	N,N’,N’’,N’’’,N’’’’,N’’’’’-Hexaacetylchitohexaose
OR22662	N, N, N, N, N, N-hexaethylphosphinetricarboxamide
AR-O01213-01	N, N’, N’’, N’’’, N’’’’, N’’’’’-Hexaacetylchitohexaose