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
-2.4563 -0.8384 0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7576 0.1481 -0.4381 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3161 0.2515 -0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4132 -0.6712 0.4984 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7784 -0.5219 0.6745 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4615 0.5497 0.1432 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7323 1.4385 -0.5526 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4091 1.3254 -0.7429 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0952 -1.6683 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5376 -0.8754 -0.1527 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2344 0.9264 -1.0157 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1052 -1.5231 0.9255 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3346 -1.2575 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5395 0.6544 0.2904 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1664 2.0619 -1.3138 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