Monomers
N-(Hydroxymethyl)acrylamide
Identifiers
IUPAC name
N-(hydroxymethyl)prop-2-enamide
InchI
InChI=1S/C4H7NO2/c1-2-4(7)5-3-6/h2,6H,1,3H2,(H,5,7)
InchI Key
CNCOEDDPFOAUMB-UHFFFAOYSA-N
SMILES
OCNC(=O)C=C
Canonical SMILES
C=CC(=O)NCO
Isomeric SMILES
C=CC(=O)NCO
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H7NO2
Heavy Atom Count
7
Molecular Weight
101.105
Exact Molecular Weight
101.0477
Valence Electrons
40
Radical Electrons
0
tPSA
49.33
MolLogP
-0.7616
H Bond Acceptors
2
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
14 13 0 0 0 0 0 0 0 0999 V2000
-2.4776 0.9425 0.2201 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1012 -0.3891 0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7856 -0.5381 -0.4784 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3492 -0.0106 0.2063 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1075 0.5859 1.3015 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6950 -0.1490 -0.3194 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6917 0.3520 0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9484 1.5641 -0.3229 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8112 -0.8450 -0.6594 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1745 -0.9385 1.0261 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6028 -1.0299 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8404 -0.6627 -1.2494 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5253 0.8608 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6921 0.2576 -0.0278 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
1 8 1 0
2 9 1 0
2 10 1 0
3 11 1 0
6 12 1 0
7 13 1 0
7 14 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers