Monomers

Tert-butyl vinylcarbamate

Identifiers

IUPAC name
tert-butyl N-ethenylcarbamate
InchI
InChI=1S/C7H13NO2/c1-5-8-6(9)10-7(2,3)4/h5H,1H2,2-4H3,(H,8,9)
InchI Key
SJDWKAHMQWSMPV-UHFFFAOYSA-N
SMILES
C=CNC(=O)OC(C)(C)C
Canonical SMILES
CC(C)(C)OC(=O)NC=C
Isomeric SMILES
CC(C)(C)OC(=O)NC=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
38.33
MolLogP
1.6546
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

 23 22  0  0  0  0  0  0  0  0999 V2000
    4.2841    1.1281    1.2673 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2146    0.3827    1.1922 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0664    0.8769    0.4757 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8818    0.0826    0.3770 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8506   -1.0361    0.9137 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2440    0.5030   -0.2939 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4312   -0.2090   -0.4340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3878    0.6514   -1.2511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2866   -1.5088   -1.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1227   -0.5019    0.8748 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3045    2.1001    0.7982 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1650    0.7937    1.7950 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2151   -0.5798    1.6652 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0711    1.7930    0.0276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8556    1.3527   -0.5126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7606    1.1946   -1.9849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1432    0.0208   -1.7577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9266   -2.3338   -0.5567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6732   -1.3206   -2.0854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3010   -1.7871   -1.5437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3681   -0.7789    1.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6566    0.4423    1.1776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8961   -1.2659    0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  7 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  3 14  1  0
  8 15  1  0
  8 16  1  0
  8 17  1  0
  9 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