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
2.5117 -0.2895 -0.6133 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6075 -0.7909 0.1817 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2332 -0.3242 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2391 0.6962 -0.5755 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5626 1.1176 -0.5073 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4340 0.5140 0.3729 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9771 -0.4792 1.1530 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6949 -0.8906 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3672 0.4976 -1.3085 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5312 -0.7013 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8688 -1.6090 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4609 1.1720 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8859 1.9344 -1.1674 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4550 0.8603 0.4054 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3320 -1.7075 1.7362 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