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
    4.1546    0.7658   -1.7790 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1771    0.1225   -1.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9015    0.7315   -0.9781 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8520    0.0493   -0.3430 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0441   -1.1227    0.0506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4052    0.5973   -0.1191 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4540   -0.0707    0.5101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8769   -1.3272   -0.1920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6330    0.9101    0.5683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1381   -0.4092    1.9622 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0145    1.7753   -2.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1085    0.3004   -1.9295 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3732   -0.9009   -0.8506 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7702    1.7009   -1.3133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5560   -1.3810   -1.2481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9972   -1.3786   -0.1355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4911   -2.2072    0.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8315    1.2252   -0.4734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5080    0.4473    1.0548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3003    1.7588    1.1920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2703    0.1696    2.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9049   -1.4987    2.0177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0290   -0.2579    2.6000 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