Monomers

Vinylcarbamic acid ethyl ester

Identifiers

IUPAC name
ethyl N-ethenylcarbamate
InchI
InChI=1S/C5H9NO2/c1-3-6-5(7)8-4-2/h3H,1,4H2,2H3,(H,6,7)
InchI Key
HNPDNOZNULJJDL-UHFFFAOYSA-N
SMILES
CCOC(=O)NC=C
Canonical SMILES
CCOC(=O)NC=C
Isomeric SMILES
CCOC(=O)NC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H9NO2
Heavy Atom Count
8
Molecular Weight
115.132
Exact Molecular Weight
115.0633
Valence Electrons
46
Radical Electrons
0
tPSA
38.33
MolLogP
0.876
H Bond Acceptors
2
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 17 16  0  0  0  0  0  0  0  0999 V2000
   -2.6271    0.3409    0.6855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0823   -1.0804    0.7649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9496   -1.1052   -0.1187 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1319   -0.2778    0.0771 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0952    0.5108    1.0681 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2783   -0.2524   -0.7557 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3588    0.6148   -0.5105 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4104    0.6226   -1.2934 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7186    0.3060    0.9285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4562    0.7153   -0.3401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1596    1.0124    1.4228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8018   -1.3167    1.7895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8870   -1.7357    0.3865 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3282   -0.8924   -1.5752 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3238    1.2800    0.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2508    1.2854   -1.1170 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5051   -0.0276   -2.1592 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  1  0
  7  8  2  3
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  6 14  1  0
  7 15  1  0
  8 16  1  0
  8 17  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers