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
    4.3822   -1.2116    0.1107 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1552   -1.1697   -0.3525 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1949   -0.3830    0.3162 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8594   -0.3186   -0.1622 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4941   -0.9545   -1.1868 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1361    0.4353    0.4466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4622    0.4910   -0.0397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5576    1.0203   -1.4372 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1660    1.5019    0.8704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1526   -0.8516    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6904   -0.6559    1.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1329   -1.8045   -0.3818 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8893   -1.7267   -1.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4500    0.1601    1.1673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5352    1.5582   -1.5232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7808    1.8095   -1.6506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5777    0.2370   -2.2140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4717    2.3701    0.9334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2376    1.0887    1.8913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1059    1.8529    0.4518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2289   -0.6537   -0.2390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7558   -1.4605   -0.8055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0805   -1.3347    1.0102 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