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
    4.0429    1.6118    1.2129 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0248    1.3382    0.4353 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9174    0.6423    0.9515 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8095    0.3430    0.1109 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8501    0.7183   -1.1047 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006   -0.3361    0.5653 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3776   -0.6148   -0.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4712   -1.3780    0.4602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0525    0.6359   -0.8236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9074   -1.4991   -1.4220 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9132    2.1525    0.8284 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1042    1.3369    2.2562 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0365    1.6425   -0.5858 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8728    0.3246    1.9631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0522   -2.1276    1.1498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1337   -1.8059   -0.3176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0802   -0.5986    0.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3555    1.4642   -1.0222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7458    0.9752   -0.0079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6366    0.3291   -1.7281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1265   -2.1997   -1.0994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7524   -2.1035   -1.8222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5792   -0.8512   -2.2699 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