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
2.6363 2.7445 -0.9333 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1115 1.6413 -0.4522 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3744 0.5218 -0.0467 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9786 0.3666 -0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2370 1.2785 -0.4994 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3286 -0.7916 0.3491 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0710 -0.9403 0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8026 0.0820 1.1473 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4143 -2.3203 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5961 -0.8633 -1.1188 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5914 2.9097 -1.0714 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2977 3.5683 -1.2237 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2156 1.5412 -0.3367 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9288 -0.3149 0.3313 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7849 0.2880 0.6415 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0570 -0.3680 2.1433 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2798 1.0354 1.2568 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2132 -3.0572 0.0909 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8049 -2.5429 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4857 -2.3433 1.2057 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9037 -1.3254 -1.8304 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5936 -1.3113 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6930 0.2010 -1.3835 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