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
    4.5616    0.3434   -0.4330 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3848    0.0366    0.0695 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1628    0.3393   -0.5941 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9252   -0.0197    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8812   -0.6066    1.1204 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2670    0.2632   -0.6203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5351   -0.0412   -0.1288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7544   -1.5259    0.0894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8538    0.6498    1.1734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5481    0.4854   -1.1532 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6884    0.8447   -1.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4491    0.0873    0.1183 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3462   -0.4673    1.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2303    0.8264   -1.5190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5263   -2.1155   -0.8170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1065   -1.8222    0.9298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8240   -1.6427    0.3704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5788   -0.0268    2.0137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4151    1.6529    1.2525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9614    0.7802    1.2128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5069   -0.0542   -1.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0853    0.4355   -2.1554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6668    1.5774   -0.9102 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