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
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
3.7874 0.9782 -0.5782 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5083 0.2289 0.4524 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2596 -0.2472 0.8705 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0265 0.0210 0.2068 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9438 0.7080 -0.8131 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1246 -0.5270 0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3744 -0.3264 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5247 -0.8137 -1.2181 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7872 1.1517 0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4297 -1.0372 1.0356 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0190 1.3121 -1.2348 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8159 1.2975 -0.8162 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3823 -0.0664 1.0763 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2520 -0.8558 1.7561 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2383 -0.0345 -1.9839 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0210 -1.7820 -1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6147 -0.9950 -1.3971 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9045 1.1463 0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6256 1.6110 1.1737 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3600 1.7009 -0.6547 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3995 -0.8117 0.5512 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3714 -0.5389 2.0375 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2194 -2.1198 1.1045 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