2-Cyano-3-Morpholinoacrylamide

CAT: 1299-RG-A261423-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-A261423-01Size:10 mg

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CAS Number

25229-97-4

Synonyms

2-cyano-3-morpholinoacrylamide

Molecular Formula

C8H11N3O2

Molecular Weight

181.2

Product Name Synonym

2-cyano-3-morpholinoacrylamide

Chemical Information

2-Cyano-3-(4-morpholinyl)-2-propenamide

CAS Number	25229-97-4
PubChem CID	91341
IUPAC Name	2-cyano-3-morpholin-4-ylprop-2-enamide
Molecular Formula	C8H11N3O2
Molecular Weight	181.19
XLogP	-0.9
Topological Polar Surface Area	79.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	270

SMILES

C1COCCN1C=C(C#N)C(=O)N

InChI

InChI=1S/C8H11N3O2/c9-5-7(8(10)12)6-11-1-3-13-4-2-11/h6H,1-4H2,(H2,10,12)

InChIKey

LLKCXVWITGBXLG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 25229-97-4

CID: 91341

Formula: C8H11N3O2

MW: 181.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.19
XLogP3	-0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	181.085126602
Monoisotopic Mass	181.085126602
Topological Polar Surface Area	79.4 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	270
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RG-A263026-01	(Z) -2-Cyano-N-Formyl-3-Morpholinoacrylamide
RG-E140745-01	2-cyano-3-hydroxy-3-morpholinopropanamide
RG-E242633-01	Ethyl 2-cyano-3-hydrazineylacrylate
RG-E200832-01	Ethyl 2-Cyano-3-Methylbutanoate
RG-A263024-01	Ethyl 2-Cyano-3-Morpholinoacrylate
RG-A263025-01	(Z) -2-Cyano-3-Hydroxyacrylamide
RG-E140126-01	Ethyl 2-cyano-3-oxobutanoate
RG-E140744-01	(E) -2-cyano-3-morpholinoacrylic acid
RG-E242634-01	Ethyl (E) -2-cyano-3-hydrazineylacrylate
RG-D090552-01	2-Cyano-3- (3,4-Dimethoxyphenyl) Acrylic Acid

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