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
    4.5457    0.1236   -0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3114    0.5293    0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1880   -0.2573   -0.2400 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8707    0.2013    0.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6898    1.3146    0.5327 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2619   -0.5427   -0.3200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5495   -0.0158   -0.0437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7919    1.2925   -0.7690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7574    0.2021    1.4332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5447   -1.0556   -0.5743 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6991   -0.8598   -0.5790 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3834    0.7482    0.1624 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1329    1.4912    0.5617 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3533   -1.1848   -0.6800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1494    2.0707   -0.0533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5335    1.1647   -1.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8381    1.6726   -1.1997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000   -0.3156    2.0501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7524    1.2864    1.6787 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7795   -0.1621    1.6728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1361   -1.4589   -1.5243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5276   -1.8924    0.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5526   -0.6162   -0.6796 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