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
    3.6718    1.4211   -0.4842 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5267    0.1326   -0.4064 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3402   -0.6130   -0.2919 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0556   -0.0413   -0.2413 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8860    1.1765   -0.2955 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0728   -0.8557   -0.1267 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3841   -0.3726   -0.0698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2978   -1.5982    0.0532 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6392    0.4514    1.1860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8106    0.3694   -1.3095 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6677    1.9030   -0.5727 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8668    2.1288   -0.4712 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4893   -0.4333   -0.4370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4259   -1.6867   -0.2401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1835   -2.2575   -0.8219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3529   -1.2421    0.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0776   -2.1613    0.9802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9177    0.1881    1.9703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6803    0.2660    1.5798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6047    1.5131    0.9105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9864    1.4604   -1.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8116    0.0143   -1.6916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1106    0.2370   -2.1603 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