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
3.8257 0.2136 -0.8231 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4561 -0.5379 0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1419 -0.7869 0.6224 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9514 -0.2548 0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0116 0.5075 -0.8869 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3158 -0.5570 0.6004 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4460 0.0065 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6639 -0.5076 0.7944 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4898 1.5021 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5636 -0.4279 -1.4168 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1859 0.7741 -1.4603 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9021 0.3079 -1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2536 -1.0509 0.7251 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9830 -1.4340 1.4559 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5355 0.0419 0.3811 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5216 -0.1928 1.8635 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7619 -1.5976 0.6842 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5518 1.8086 -0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1993 1.9121 1.0577 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9117 1.9737 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6243 -0.9243 -1.7455 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3552 -1.2139 -1.4994 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7709 0.4376 -2.0782 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