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
-2.4410 0.7252 0.3111 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7425 -0.3636 0.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3048 -0.3589 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3852 0.8224 0.1595 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7828 0.8157 0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4359 -0.3817 -0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7237 -1.4957 -0.0808 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4002 -1.5465 -0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9954 1.7071 0.3561 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5411 0.6744 0.3692 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2564 -1.3185 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0937 1.8093 0.2567 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2904 1.7623 0.1197 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5248 -0.3651 -0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1681 -2.4864 -0.0454 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