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
   -1.8452    2.1888   -0.0638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7405    0.7900   -0.6340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6793    0.0217   -0.0433 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6098    0.0725   -0.6368 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7962    0.7783   -1.6529 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7055   -0.6261   -0.1530 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9585   -0.5883   -0.7144 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8423    0.3007   -0.3375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8234   -0.8098    1.1231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2004   -2.2090    0.8772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7532    2.3090    0.5786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9879    2.4702    0.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9463    2.9558   -0.8602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7353    0.3284   -0.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5515    0.9078   -1.7213 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2189   -1.2948   -1.4712 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6088    1.0307    0.4276 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8337    0.3533   -0.7612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5972   -0.3051    1.7711 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1225   -0.7595    1.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2833   -2.4307    0.9342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7376   -2.8462    1.6897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8151   -2.6374   -0.0748 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