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
   -1.0320   -1.8612   -0.7076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281   -1.1065    0.5720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5583    0.3014    0.3437 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6999    0.8191    0.0537 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8612    2.0404   -0.1467 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7797   -0.0340   -0.0119 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0610    0.3325   -0.2846 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0099   -0.5695   -0.3207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6973    1.1786    0.4161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3873    1.3363   -0.9181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4059   -1.5198   -1.5363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1140   -1.7739   -0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8071   -2.9386   -0.4965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2157   -1.5682    0.9834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5112   -1.3383    1.3173 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2923    1.3598   -0.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0195   -0.2590   -0.5386 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8100   -1.6358   -0.1354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4389    0.8880    1.1778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3309    2.1985    0.7332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4901    1.3055   -0.7898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1128    0.5379   -1.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1353    2.3069   -1.3923 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