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
    4.5324   -0.1186    0.5390 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3177    0.3987    0.5690 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2002   -0.3437    0.1094 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9001    0.2063    0.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6605    1.3590    0.5659 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1542   -0.5332   -0.3092 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4861   -0.1327   -0.3431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7673    1.0762   -1.1694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9418    0.1700    1.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3063   -1.3346   -0.8239 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6679   -1.1154    0.1602 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4029    0.4137    0.8786 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1739    1.3955    0.9465 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3169   -1.3180   -0.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1390    1.1665   -2.0714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8598    1.0221   -1.4402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6719    1.9704   -0.5289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4507    1.0347    1.5154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0418    0.4211    1.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8329   -0.7703    1.6568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7004   -2.2650   -0.8095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1752   -1.5118   -0.1572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6449   -1.1910   -1.8674 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