Monomers

Carbamic acid, diethyl-, ethenyl ester

Identifiers

IUPAC name
ethenyl N,N-diethylcarbamate
InchI
InChI=1S/C7H13NO2/c1-4-8(5-2)7(9)10-6-3/h6H,3-5H2,1-2H3
InchI Key
RCTMPBPPPDIMPF-UHFFFAOYSA-N
SMILES
CCN(C(=O)OC=C)CC
Canonical SMILES
CCN(CC)C(=O)OC=C
Isomeric SMILES
CCN(CC)C(=O)OC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H13NO2
Heavy Atom Count
10
Molecular Weight
143.186
Exact Molecular Weight
143.0946
Valence Electrons
58
Radical Electrons
0
tPSA
29.54
MolLogP
1.6083
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 23 22  0  0  0  0  0  0  0  0999 V2000
   -1.1028    0.1217    2.2589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9949    0.7745    0.9032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6482   -0.1434   -0.1381 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7164   -0.4101   -0.4900 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0071   -1.2186   -1.4067 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7788    0.2067    0.1590 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0888   -0.0731   -0.2054 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0816    0.5275    0.4281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6845   -0.8227   -0.8582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1410   -0.0642   -2.0737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1536    0.0785    2.6151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6830   -0.8921    2.2602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5345    0.6979    3.0338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2945    1.6284    0.9942 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9835    1.2073    0.6621 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3514   -0.7659   -0.9913 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8827    1.2301    1.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1171    0.3522    0.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2936   -1.8141   -1.1686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5831   -0.9754   -0.2050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2415   -0.2406   -2.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0392    1.0379   -1.9640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6458   -0.4427   -2.9897 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
  3  9  1  0
  9 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  7 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
 10 21  1  0
 10 22  1  0
 10 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers