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
-2.5351 -0.5943 0.1534 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7452 0.4270 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2966 0.3020 -0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3777 -0.8672 0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7652 -0.8608 0.0895 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5092 0.2835 -0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8161 1.4283 -0.2643 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4820 1.4492 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6283 -0.4799 0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2084 -1.6083 0.3016 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1994 1.4070 -0.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1898 -1.7763 0.2782 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2938 -1.7903 0.2198 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5939 0.2831 -0.1313 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0350 2.3971 -0.3684 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