Monomers
3-Vinylpyridine
Identifiers
IUPAC name
3-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InchI Key
DPZYLEIWHTWHCU-UHFFFAOYSA-N
SMILES
C=Cc1cccnc1
Canonical SMILES
C=CC1=CN=CC=C1
Isomeric SMILES
C=CC1=CN=CC=C1
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H7N
Heavy Atom Count
8
Molecular Weight
105.14
Exact Molecular Weight
105.0578
Valence Electrons
40
Radical Electrons
0
tPSA
12.89
MolLogP
1.7246
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
15 15 0 0 0 0 0 0 0 0999 V2000
2.6689 -0.1470 0.1837 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5662 -0.8273 -0.0292 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2635 -0.2000 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8935 -0.9610 -0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1155 -0.3431 -0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2917 1.0037 0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1809 1.7229 0.2251 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0529 1.1357 0.2141 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6424 -0.6495 0.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7327 0.9138 0.3849 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6295 -1.8847 -0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7382 -2.0121 -0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9902 -0.9621 -0.4141 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2855 1.4500 0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9394 1.7606 0.3996 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
8 3 1 0
1 9 1 0
1 10 1 0
2 11 1 0
4 12 1 0
5 13 1 0
6 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers