acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene

C236H148 — CID 157163484

About acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene

acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene (PubChem CID 157163484) has the molecular formula C236H148 and a molecular weight of 2983.78 g/mol. Its IUPAC name is acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene.

Molecular Properties

• Compound Name: acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene
• PubChem CID: 157163484
• Molecular Formula: C236H148
• Molecular Weight: 2983.78 g/mol
• Exact Mass: 2981.16
• IUPAC Name: acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene
• SMILES: C1=Cc2cccc3cccc1c23.c1cc2c3c(c1)ccc1ccc4cccc-2c4c13.c1cc2c3c(cccc3c1)CC2.c1cc2ccc3ccc4ccc5ccc6ccc1c1c2c3c4c5c61.c1cc2ccc3ccc4ccc5cccc6c(c1)c2c3c4c56.c1cc2ccc3cccc4ccc(c1)c2c34.c1cc2cccc3c4cccc5cccc(c(c1)c23)c54.c1ccc2c(c1)-c1cccc3cccc-2c13.c1ccc2c(c1)ccc1c3ccccc3ccc21.c1ccc2c(c1)ccc1ccc3ccccc3c12.c1ccc2c(c1)ccc1ccccc12.c1ccc2c3c4c(ccc5ccc6cccc-3c6c54)cc2c1.c1ccc2cc3ccccc3cc2c1.c1ccc2ccccc2c1
• InChI: InChI=1S/C24H12.2C22H12.C20H12.C18H10.2C18H12.2C16H10.2C14H10.C12H10.C12H8.C10H8/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19;1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18;1-2-6-17-15(4-1)12-16-11-10-14-9-8-13-5-3-7-18-19(13)20(14)21(16)22(17)18;1-5-13-6-2-11-17-18-12-4-8-14-7-3-10-16(20(14)18)15(9-1)19(13)17;1-3-11-7-9-13-10-8-12-4-2-6-15-14(5-1)16(11)18(13)17(12)15;1-3-7-16-13(5-1)9-11-15-12-10-14-6-2-4-8-17(14)18(15)16;1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18;1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14;1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;2*1-3-9-4-2-6-11-8-7-10(5-1)12(9)11;1-2-6-10-8-4-3-7-9(10)5-1/h1-12H;2*1-12H;1-12H;1-10H;2*1-12H;2*1-10H;2*1-10H;1-6H,7-8H2;1-8H;1-8H
• InChIKey: AMQKEJHODCKHQS-UHFFFAOYSA-N
• XLogP: 66.84
• TPSA: 0.00 Ų
• Heavy Atoms: 236
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2983.78
LogP ≤ 5	66.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene?

The IUPAC name of acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene (CID 157163484) is acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene.

What is the SMILES notation for acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene?

The canonical SMILES for acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene is C1=Cc2cccc3cccc1c23.c1cc2c3c(c1)ccc1ccc4cccc-2c4c13.c1cc2c3c(cccc3c1)CC2.c1cc2ccc3ccc4ccc5ccc6ccc1c1c2c3c4c5c61.c1cc2ccc3ccc4ccc5cccc6c(c1)c2c3c4c56.c1cc2ccc3cccc4ccc(c1)c2c34.c1cc2cccc3c4cccc5cccc(c(c1)c23)c54.c1ccc2c(c1)-c1cccc3cccc-2c13.c1ccc2c(c1)ccc1c3ccccc3ccc21.c1ccc2c(c1)ccc1ccc3ccccc3c12.c1ccc2c(c1)ccc1ccccc12.c1ccc2c3c4c(ccc5ccc6cccc-3c6c54)cc2c1.c1ccc2cc3ccccc3cc2c1.c1ccc2ccccc2c1.

What is the InChIKey of acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene?

The InChIKey is AMQKEJHODCKHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H12.2C22H12.C20H12.C18H10.2C18H12.2C16H10.2C14H10.C12H10.C12H8.C10H8/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19;1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18;1-2-6-17-15(4-1)12-16-11-10-14-9-8-13-5-3-7-18-19(13)20(14)21(16)22(17)18;1-5-13-6-2-11-17-18-12-4-8-14-7-3-10-16(20(14)18)15(9-1)19(13)17;1-3-11-7-9-13-10-8-12-4-2-6-15-14(5-1)16(11)18(13)17(12)15;1-3-7-16-13(5-1)9-11-15-12-10-14-6-2-4-8-17(14)18(15)16;1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18;1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14;1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13;1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;2*1-3-9-4-2-6-11-8-7-10(5-1)12(9)11;1-2-6-10-8-4-3-7-9(10)5-1/h1-12H;2*1-12H;1-12H;1-10H;2*1-12H;2*1-10H;2*1-10H;1-6H,7-8H2;1-8H;1-8H.

What are the key properties of acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene?

acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene has a molecular weight of 2983.78 g/mol, XLogP of 66.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for acenaphthylene;anthracene;benzo[c]phenanthrene;chrysene;coronene;1,2-dihydroacenaphthylene;fluoranthene;hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene;hexacyclo[12.8.0.02,11.03,8.04,22.016,21]docosa-1(22),2(11),3(8),4,6,9,12,14,16,18,20-undecaene;naphthalene;pentacyclo[8.8.0.02,7.03,17.013,18]octadeca-1(10),2(7),3,5,8,11,13(18),14,16-nonaene;perylene;phenanthrene;pyrene is sourced from PubChem (CID 157163484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).