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
    4.3418    1.2666   -0.7135 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3183    0.6660   -0.1373 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0258    0.8235   -0.6987 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8811    0.2052   -0.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0283   -0.4878    0.8845 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3917    0.3334   -0.6443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5068   -0.2962   -0.0515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3735   -1.7980   -0.0066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8176    0.1943    1.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6915    0.0155   -0.9516 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2269    1.8716   -1.5951 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3306    1.1580   -0.3009 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4422    0.0660    0.7395 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8713    1.3999   -1.5504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9241   -2.1208   -0.9512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8582   -2.1657    0.8919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4060   -2.2132    0.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2391    1.1121    1.5374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9081    0.3154    1.4398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5108   -0.5468    2.1076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5158   -0.6945   -0.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3291   -0.1695   -1.9963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9941    1.0650   -0.9028 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