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
3.8330 -0.0678 -0.0928 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8697 0.8120 -0.1081 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4917 0.4559 -0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3995 1.3974 -0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5056 2.6401 -0.1455 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8505 0.6556 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5595 -0.6897 -0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8897 -0.8200 -0.1374 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4568 -1.9411 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6122 -1.6125 -0.1752 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9134 -1.1739 -0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2281 0.1763 -0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1848 1.0707 -0.1857 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8650 0.2384 -0.0772 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5917 -1.1136 -0.0958 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1310 1.8625 -0.1048 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3615 -2.6473 -0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6886 -1.9204 -0.2068 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2487 0.5339 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3864 2.1436 -0.1895 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