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
    3.5499    1.9027    2.0621 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8369    1.4978    1.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5873    0.8832    1.2859 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7889    0.4336    0.2062 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1535    0.5621   -0.9848 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4193   -0.1608    0.4560 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3094   -0.6504   -0.4957 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8026    0.3899   -1.4612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6603   -1.7602   -1.3301 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4779   -1.2769    0.2786 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5099    2.3758    1.8825 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2297    1.7882    3.0737 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1713    1.6200    0.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2225    0.7451    2.2696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8342    0.1102   -1.7970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7807    1.3929   -0.9880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1514    0.3825   -2.3616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4076   -2.1674   -2.0378 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1404   -1.3099   -1.9505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2583   -2.5645   -0.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0373   -2.1437    0.8124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7339   -0.5216    1.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3173   -1.5285   -0.3750 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