Monomers
Carbamic acid, diethyl-, ethenyl ester
Identifiers
IUPAC name
ethenyl N,N-diethylcarbamate
InchI
InChI=1S/C7H13NO2/c1-4-8(5-2)7(9)10-6-3/h6H,3-5H2,1-2H3
InchI Key
RCTMPBPPPDIMPF-UHFFFAOYSA-N
SMILES
CCN(C(=O)OC=C)CC
Canonical SMILES
CCN(CC)C(=O)OC=C
Isomeric SMILES
CCN(CC)C(=O)OC=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
29.54
MolLogP
1.6083
H Bond Acceptors
2
H Bond Donors
0
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
-1.7127 1.8091 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4041 0.5991 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5326 -0.3311 -0.0844 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8619 -0.1971 0.0591 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6142 -1.0126 -0.5265 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4558 0.7979 0.8205 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8305 0.8762 0.9217 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5656 1.5901 0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0812 -1.3886 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3345 -2.6492 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8190 2.4497 -0.4048 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1621 1.5039 -1.2501 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4952 2.3837 0.2639 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9505 1.0076 1.5285 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3677 0.1533 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3699 0.3561 1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6391 1.6554 0.1449 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1043 2.1434 -0.7423 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3874 -1.6802 -1.7231 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0432 -1.0935 -1.3545 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4170 -3.5240 -0.7585 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2587 -2.5849 0.5235 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4755 -2.8644 0.5979 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 3
3 9 1 0
9 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
2 14 1 0
2 15 1 0
7 16 1 0
8 17 1 0
8 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