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
-2.5850 -0.5314 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7028 0.4131 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2774 0.2972 -0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3172 -0.8248 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6859 -0.8261 0.5858 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4958 0.2475 0.2855 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9006 1.3336 -0.2355 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5801 1.3676 -0.4519 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6559 -0.3927 -0.4064 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2339 -1.4694 0.2379 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0819 1.3321 -0.8467 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2809 -1.6879 0.6245 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1552 -1.7257 1.0137 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5700 0.2132 0.4641 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1132 2.2536 -0.8741 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