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
    3.8664    0.9071    0.0982 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0042    1.8814    0.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6016    1.7898    0.1236 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8265    0.6123    0.0127 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3817   -0.4834   -0.0645 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5593    0.6312   -0.0139 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3878   -0.4601   -0.1189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1495   -1.3909    1.0497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2571   -1.2591   -1.3818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8368    0.0416   -0.0297 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9208    1.1082    0.1358 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5743   -0.1117    0.0099 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4336    2.9027    0.2507 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0362    2.6892    0.1848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3759   -2.1420    0.7654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7829   -0.8541    1.9448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0811   -1.9481    1.3247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2923   -1.7793   -1.4191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4792   -0.6612   -2.2922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0426   -2.0525   -1.3442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5328   -0.7523   -0.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9058    0.9427   -0.6852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9621    0.3885    1.0253 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