Monomers
N-Vinylphthalimide
Identifiers
IUPAC name
2-ethenylisoindole-1,3-dione
InchI
InChI=1S/C10H7NO2/c1-2-11-9(12)7-5-3-4-6-8(7)10(11)13/h2-6H,1H2
InchI Key
IGDLZDCWMRPMGL-UHFFFAOYSA-N
SMILES
C=CN1C(=O)c2c(C1=O)cccc2
Canonical SMILES
C=CN1C(=O)C2=CC=CC=C2C1=O
Isomeric SMILES
C=CN1C(=O)C2=CC=CC=C2C1=O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H7NO2
Heavy Atom Count
13
Molecular Weight
173.171
Exact Molecular Weight
173.0477
Valence Electrons
64
Radical Electrons
0
tPSA
37.38
MolLogP
1.4261
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1
MOL File
RDKit 3D
20 21 0 0 0 0 0 0 0 0999 V2000
3.7365 0.7551 -0.4902 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9872 -0.1877 0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5696 -0.1197 0.0187 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6897 -1.1322 0.5632 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0932 -2.1907 1.0962 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6985 -0.7375 0.3982 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7085 0.4872 -0.2311 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6836 0.8756 -0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0544 1.9581 -1.0353 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9135 1.0913 -0.5087 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1208 0.4871 -0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1128 -0.7347 0.4627 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9133 -1.3406 0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2878 1.6263 -0.9257 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8291 0.6817 -0.4823 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4729 -1.0514 0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9214 2.0539 -1.0033 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0759 0.9553 -0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0732 -1.1800 0.7177 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8662 -2.2969 1.2316 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 2 0
7 8 1 0
8 9 2 0
7 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
8 3 1 0
13 6 1 0
1 14 1 0
1 15 1 0
2 16 1 0
10 17 1 0
11 18 1 0
12 19 1 0
13 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers