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
-2.4998 -0.7010 -0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4757 -1.6165 0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1766 -1.1409 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9194 -1.9740 0.2389 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1833 -1.3767 0.2974 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3502 -0.0111 0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2707 0.8103 0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0289 0.2182 -0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9625 1.1451 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2631 0.6669 -0.2462 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3069 2.4351 -0.2246 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0183 2.2411 -0.0964 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5046 -1.0976 -0.2076 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6167 -2.6751 0.0811 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7780 -3.0388 0.3137 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0183 -2.0529 0.4233 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3316 0.4233 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0524 1.3766 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8262 3.3847 -0.3461 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7856 2.9833 -0.0919 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