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
    4.5390   -0.3917    0.6157 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2636   -0.6211    0.8712 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2454    0.0525    0.1653 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8621   -0.1637    0.4078 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4703   -0.9785    1.2767 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1070    0.5162   -0.3052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4655    0.3206   -0.0848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9358    0.6286    1.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2388    1.1497   -1.1160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8491   -1.1361   -0.3799 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8171    0.3291   -0.1524 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3501   -0.8758    1.1222 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0443   -1.3458    1.6428 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5432    0.7481   -0.5762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4709    1.5392    1.7374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0338    0.8811    1.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8300   -0.2659    1.9305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3275    1.0261   -0.9399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9686    0.7679   -2.1206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9132    2.2003   -1.0546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4796   -1.4214   -1.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5392   -1.8137    0.4229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9762   -1.1455   -0.4488 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