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
-2.4405 -1.6659 0.4811 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9122 -0.6103 -0.4321 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6532 -0.0578 0.0098 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5915 -0.6055 -0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5755 -1.6014 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8133 -0.1038 0.0163 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9961 -0.6903 -0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1617 -0.2027 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7039 1.0970 0.8885 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7052 2.3898 0.1304 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5645 -1.6710 0.3762 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0991 -2.6522 0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1894 -1.4911 1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6757 0.2142 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7463 -1.0638 -1.4316 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9843 -1.5505 -1.0657 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2294 0.6483 0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0916 -0.6487 -0.3436 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6394 1.0676 1.4976 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1358 1.0311 1.6265 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3038 2.7424 -0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3698 2.2652 -0.7534 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1839 3.1594 0.7746 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