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
-1.1714 2.3060 0.3618 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2152 2.1374 0.2534 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7576 0.8881 0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1111 0.6124 -0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5385 -0.7034 -0.2478 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6096 -1.7212 -0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2414 -1.4613 -0.1977 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1367 -0.1553 -0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5012 -0.0130 0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0658 1.2566 0.2871 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0190 -1.3661 -0.0434 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9961 -2.2220 -0.2148 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5708 3.3038 0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8923 2.9728 0.3151 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8021 1.4398 0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5912 -0.9004 -0.3387 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9071 -2.7398 -0.4623 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1219 1.3368 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0428 -1.6741 -0.0174 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0403 -3.2970 -0.3462 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