Monomers
4-Vinylpyridine
Identifiers
IUPAC name
4-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
InchI Key
KFDVPJUYSDEJTH-UHFFFAOYSA-N
SMILES
C=Cc1ccncc1
Canonical SMILES
C=CC1=CC=NC=C1
Isomeric SMILES
C=CC1=CC=NC=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
2.4511 -0.6113 0.3255 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6501 0.2864 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2161 0.1949 -0.1156 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5779 1.1671 -0.6701 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9705 1.1082 -0.6195 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5208 0.0446 0.0039 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7766 -0.9193 0.5542 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3939 -0.8632 0.5054 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5434 -0.5101 0.2539 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1207 -1.4919 0.8402 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1096 1.1495 -0.6915 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1111 1.9947 -1.1557 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5857 1.8812 -1.0606 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3036 -1.7437 1.0387 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1492 -1.6868 0.9767 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
7 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers