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
3.6373 1.0687 -0.3085 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8782 0.4458 0.5582 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5221 0.2323 0.2923 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6152 -0.4439 1.1904 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9142 -0.9251 2.3146 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7143 -0.4916 0.6039 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6513 0.1321 -0.6216 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7242 0.5815 -0.8216 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1342 1.1889 -1.8363 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8133 0.2059 -1.3673 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9955 -0.3269 -0.8998 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0667 -0.9537 0.3279 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9079 -1.0269 1.0706 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7064 1.2271 -0.0788 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3430 1.4648 -1.2585 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3219 0.0996 1.4842 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7792 0.6901 -2.3262 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9250 -0.2815 -1.4687 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0153 -1.3714 0.6832 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9281 -1.5158 2.0463 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