Monomers
Acenaphthylene
Identifiers
IUPAC name
acenaphthylene
InchI
InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
InchI Key
HXGDTGSAIMULJN-UHFFFAOYSA-N
SMILES
c1cc2cccc3c2c(c1)C=C3
Canonical SMILES
C1=CC2=C3C(=C1)C=CC3=CC=C2
Isomeric SMILES
C1=CC2=C3C(=C1)C=CC3=CC=C2
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C12H8
Heavy Atom Count
12
Molecular Weight
152.196
Exact Molecular Weight
152.0626
Valence Electrons
56
Radical Electrons
0
tPSA
0.0
MolLogP
3.3236
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
2
MOL File
RDKit 3D
20 22 0 0 0 0 0 0 0 0999 V2000
2.2944 1.2173 -0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1031 1.9316 -0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0529 1.1741 -0.0107 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3230 1.7423 0.0898 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4110 0.8995 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2861 -0.4859 0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0384 -1.0422 0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0310 -0.1940 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1829 -0.9318 -0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3395 -0.1847 -0.1961 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7959 -2.3504 -0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5545 -2.4086 0.0782 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2157 1.7699 -0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0539 3.0001 -0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4203 2.8330 0.0839 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4030 1.3691 0.2711 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1740 -1.1074 0.2837 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2678 -0.7342 -0.2678 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4862 -3.1654 -0.0852 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1073 -3.3324 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
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 9 1 0
9 10 2 0
9 11 1 0
11 12 2 0
10 1 1 0
8 3 1 0
12 7 1 0
1 13 1 0
2 14 1 0
4 15 1 0
5 16 1 0
6 17 1 0
10 18 1 0
11 19 1 0
12 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers