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
4.5521 0.0743 0.4257 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4021 -0.1707 -0.1162 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1799 0.1936 0.5524 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9095 -0.0503 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8542 -0.6147 -1.1202 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2879 0.2755 0.6001 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5569 0.0319 0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6701 0.7583 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8579 -1.4243 -0.1514 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5965 0.6201 0.9783 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4644 -0.1964 -0.0711 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6073 0.5541 1.3843 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2897 -0.6559 -1.0885 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2232 0.6623 1.4884 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1718 0.1170 -2.0277 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7325 0.9563 -1.5391 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1790 1.7687 -1.2098 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9757 -1.5036 -0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3660 -1.8575 -1.0459 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6225 -1.9535 0.7851 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7634 -0.0330 1.8312 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2033 1.6306 1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4991 0.8171 0.3672 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