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
2.4883 -0.7367 -0.1647 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0796 0.5980 -0.2695 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7354 0.8867 -0.1687 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1970 2.1691 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1807 2.3630 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0026 1.2596 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4948 -0.0204 0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1335 -0.1585 0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2731 -1.4651 0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6256 -1.7897 0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9518 -2.2243 0.3353 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0059 -1.3804 0.3472 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5508 -0.9067 -0.2507 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7550 1.4092 -0.4241 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8567 2.9901 -0.4091 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6010 3.3606 -0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0729 1.3689 0.1535 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9472 -2.8162 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0259 -3.2865 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0397 -1.6207 0.4750 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