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
-2.0682 0.9371 1.3084 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4333 -0.1928 1.0818 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2467 -0.2893 0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3120 0.7956 -0.3923 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4534 0.6371 -1.1889 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0335 -0.5991 -1.3533 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4713 -1.6591 -0.7242 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3744 -1.5100 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7748 1.8911 0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9324 0.9293 1.9382 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8050 -1.1070 1.5419 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1331 1.7725 -0.2721 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8764 1.5187 -1.6797 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9160 -0.7295 -1.9676 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0434 -2.3947 0.5296 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