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
-2.5322 0.6352 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7394 -0.3683 -0.3648 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3066 -0.3067 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3283 0.8183 0.3277 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7056 0.7831 0.5036 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4798 -0.3241 0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8219 -1.4024 -0.2361 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5039 -1.4184 -0.4215 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1372 1.5567 0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6068 0.5714 -0.2949 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1394 -1.3070 -0.7439 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2007 1.7286 0.5702 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2365 1.6662 0.8813 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5612 -0.3183 0.3761 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0251 -2.3143 -0.7966 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