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
    4.3976    0.1627   -1.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2597    0.4652   -0.7089 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0694   -0.2478   -0.9976 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8640    0.1035   -0.3359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8539    1.0461    0.5052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2920   -0.5999   -0.6260 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4817   -0.2335    0.0442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7805    1.2019   -0.2905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6691   -1.0509   -0.4802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4203   -0.4911    1.5241 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4938   -0.6243   -2.0353 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2797    0.7291   -1.0598 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2208    1.2628    0.0116 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0330   -1.0376   -1.6893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3508    1.4042   -1.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8740    1.3904   -0.3966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3035    1.9278    0.4044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4936   -0.8537    0.2458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0063   -0.6523   -1.4555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4724   -2.1205   -0.4764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8516   -1.4354    1.6704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4471   -0.7022    1.9102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0290    0.3554    2.1025 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