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
-1.3459 -2.2130 0.3326 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0223 -2.2154 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6403 -0.9722 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0049 -0.8250 -0.1388 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5349 0.4391 -0.3038 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7365 1.5789 -0.3187 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3757 1.4529 -0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1165 0.1804 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4674 0.1881 0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0858 -1.0277 0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8618 1.6010 0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7849 2.3487 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8546 -3.1796 0.4696 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6635 -3.0737 0.1964 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6001 -1.7150 -0.1242 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6115 0.5700 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1432 2.5772 -0.4477 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1638 -1.0329 0.4211 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9014 1.9029 0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7508 3.4154 -0.2169 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