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
-2.5598 -0.6555 -0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6832 0.2908 -0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2828 0.1034 -0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6258 1.1515 -0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9725 1.0062 -0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3691 -0.2242 0.4382 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5091 -1.2234 0.6473 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1756 -1.0948 0.3999 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3792 -1.6530 0.1997 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6363 -0.4863 -0.3899 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0153 1.2532 -0.7348 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2431 2.0900 -0.6748 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7002 1.7902 -0.1974 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4359 -0.3838 0.6554 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4747 -1.9642 0.5967 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