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
4.5382 -0.1058 0.5404 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3442 0.4208 0.3412 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2201 -0.4527 0.3057 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9384 0.1190 0.0911 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8322 1.3435 -0.0573 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2228 -0.6475 0.0393 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5023 -0.1389 -0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4659 -1.3325 -0.1491 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9681 0.7945 0.9219 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6682 0.4989 -1.5455 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4204 0.5184 0.5751 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6694 -1.1630 0.6732 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2489 1.4892 0.2114 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3234 -1.4794 0.4318 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5057 -1.7994 0.8403 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4570 -0.9695 -0.4182 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0952 -2.0363 -0.9411 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1604 1.3028 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7035 1.5027 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5656 0.2514 1.7034 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7901 -0.2964 -2.3316 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8061 1.1314 -1.8158 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6241 1.0486 -1.5252 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