pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene

C20H12 — CID 177452686

IUPACpentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene
SMILESC1=C2C=c3ccccc3=C2c2cc3ccccc3cc21
InChIInChI=1S/C20H12/c1-2-6-14-12-19-16(9-13(14)5-1)11-17-10-15-7-3-4-8-18(15)20(17)19/h1-12H
InChIKeySWAFNGHKDMABFV-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.23
Rot. Bonds

About pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene

pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene (PubChem CID 177452686) has the molecular formula C20H12 and a molecular weight of 252.32 g/mol. Its IUPAC name is pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene.

Molecular Properties

Compound Namepentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene
PubChem CID177452686
Molecular FormulaC20H12
Molecular Weight252.32 g/mol
Exact Mass252.09
IUPAC Namepentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene
SMILESC1=C2C=c3ccccc3=C2c2cc3ccccc3cc21
InChIInChI=1S/C20H12/c1-2-6-14-12-19-16(9-13(14)5-1)11-17-10-15-7-3-4-8-18(15)20(17)19/h1-12H
InChIKeySWAFNGHKDMABFV-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene with MolForge

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Related Compounds

decacyclo[19.19.0.02,19.04,17.06,15.08,13.022,39.024,37.026,35.028,33]tetraconta-1(40),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38-icosaene
CID 102341942
3-methyl-2H-anthracen-1-one
CID 141307258
tetracyclo[10.3.1.02,10.03,8]hexadeca-1(15),2,4,6,8,10,12(16),13-octaene
CID 173242499
3-ethylanthracene-1,2-dione
CID 19425075
3-methylidenecyclopenta[b]naphthalene
CID 12699885
(8Z)-pentacyclo[14.8.0.02,7.010,15.018,23]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaene
CID 177396805
benzo[a]anthracene-6,12-dione
CID 171714643
dodecacyclo[24.24.0.03,24.05,22.07,20.09,18.011,16.028,49.030,47.032,45.034,43.036,41]pentaconta-1(50),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48-pentacosaene
CID 54171203
anthracene;silane
CID 131739126
lithium anthracene
CID 22662646
anthracene;vanadium
CID 173418141
CID 158474185
CID 158474185

Frequently Asked Questions

What is the IUPAC name of pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene?
The IUPAC name of pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene (CID 177452686) is pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene.
What is the SMILES notation for pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene?
The canonical SMILES for pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene is C1=C2C=c3ccccc3=C2c2cc3ccccc3cc21.
What is the InChIKey of pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene?
The InChIKey is SWAFNGHKDMABFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12/c1-2-6-14-12-19-16(9-13(14)5-1)11-17-10-15-7-3-4-8-18(15)20(17)19/h1-12H.
What are the key properties of pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene?
pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene has a molecular weight of 252.32 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentacyclo[10.8.0.02,10.03,8.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene is sourced from PubChem (CID 177452686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).