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
-2.6508 -0.3855 0.3785 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7074 0.4637 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3045 0.1084 0.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6276 1.0984 -0.3282 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9663 0.7851 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4107 -0.4908 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5253 -1.4465 0.1774 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2077 -1.1367 0.2467 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6747 -0.0870 0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3964 -1.4035 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9955 1.4841 -0.1352 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2791 2.1002 -0.5277 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7037 1.5405 -0.6579 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4852 -0.7011 -0.2116 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4764 -1.9293 0.5086 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