9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene

C202H204 — CID 158936790

IUPAC9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene
SMILESCc1cc(C)c(C)cc1C.Cc1cc2c(-c3ccccc3)c3cc(C)c(C)cc3c(-c3ccccc3)c2cc1C.Cc1cc2c3cccc4c(C)c(C)cc(c5cccc(c1C)c52)c43.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2c3ccccc3c(-c3ccc(C)c(C)c3)c3ccccc23)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1ccc2c3ccc(C)c4c(C)ccc(c5ccc(C)c1c25)c43
InChIInChI=1S/2C30H26.2C24H20.2C16H18.3C14H16.2C10H14/c1-19-13-15-23(17-21(19)3)29-25-9-5-7-11-27(25)30(28-12-8-6-10-26(28)29)24-16-14-20(2)22(4)18-24;1-19-15-25-26(16-20(19)2)30(24-13-9-6-10-14-24)28-18-22(4)21(3)17-27(28)29(25)23-11-7-5-8-12-23;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;1-13-11-21-19-9-6-8-18-16(4)14(2)12-22(24(18)19)20-10-5-7-17(15(13)3)23(20)21;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h2*5-18H,1-4H3;2*5-12H,1-4H3;2*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3
InChIKeyJJTCLUBOOLGMQX-UHFFFAOYSA-N
MW2631.85 g/mol
LogP58.30
Rot. Bonds6

About 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene

9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene (PubChem CID 158936790) has the molecular formula C202H204 and a molecular weight of 2631.85 g/mol. Its IUPAC name is 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene.

Molecular Properties

Compound Name9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene
PubChem CID158936790
Molecular FormulaC202H204
Molecular Weight2631.85 g/mol
Exact Mass2629.60
IUPAC Name9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene
SMILESCc1cc(C)c(C)cc1C.Cc1cc2c(-c3ccccc3)c3cc(C)c(C)cc3c(-c3ccccc3)c2cc1C.Cc1cc2c3cccc4c(C)c(C)cc(c5cccc(c1C)c52)c43.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2c3ccccc3c(-c3ccc(C)c(C)c3)c3ccccc23)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1ccc2c3ccc(C)c4c(C)ccc(c5ccc(C)c1c25)c43
InChIInChI=1S/2C30H26.2C24H20.2C16H18.3C14H16.2C10H14/c1-19-13-15-23(17-21(19)3)29-25-9-5-7-11-27(25)30(28-12-8-6-10-26(28)29)24-16-14-20(2)22(4)18-24;1-19-15-25-26(16-20(19)2)30(24-13-9-6-10-14-24)28-18-22(4)21(3)17-27(28)29(25)23-11-7-5-8-12-23;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;1-13-11-21-19-9-6-8-18-16(4)14(2)12-22(24(18)19)20-10-5-7-17(15(13)3)23(20)21;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h2*5-18H,1-4H3;2*5-12H,1-4H3;2*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3
InChIKeyJJTCLUBOOLGMQX-UHFFFAOYSA-N
XLogP58.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms202
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002631.85
LogP ≤ 558.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene?
The IUPAC name of 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene (CID 158936790) is 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene.
What is the SMILES notation for 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene?
The canonical SMILES for 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene is Cc1cc(C)c(C)cc1C.Cc1cc2c(-c3ccccc3)c3cc(C)c(C)cc3c(-c3ccccc3)c2cc1C.Cc1cc2c3cccc4c(C)c(C)cc(c5cccc(c1C)c52)c43.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2c3ccccc3c(-c3ccc(C)c(C)c3)c3ccccc23)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(-c2cccc(C)c2C)cc1C.Cc1ccc(C)c(C)c1C.Cc1ccc(C)c2c(C)ccc(C)c12.Cc1ccc2c(C)c(C)ccc2c1C.Cc1ccc2c3ccc(C)c4c(C)ccc(c5ccc(C)c1c25)c43.
What is the InChIKey of 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene?
The InChIKey is JJTCLUBOOLGMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C30H26.2C24H20.2C16H18.3C14H16.2C10H14/c1-19-13-15-23(17-21(19)3)29-25-9-5-7-11-27(25)30(28-12-8-6-10-26(28)29)24-16-14-20(2)22(4)18-24;1-19-15-25-26(16-20(19)2)30(24-13-9-6-10-14-24)28-18-22(4)21(3)17-27(28)29(25)23-11-7-5-8-12-23;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;1-13-11-21-19-9-6-8-18-16(4)14(2)12-22(24(18)19)20-10-5-7-17(15(13)3)23(20)21;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)16-7-5-6-12(2)14(16)4;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-9-5-6-11(3)14-12(4)8-7-10(2)13(9)14;1-7-5-9(3)10(4)6-8(7)2;1-7-5-6-8(2)10(4)9(7)3/h2*5-18H,1-4H3;2*5-12H,1-4H3;2*5-10H,1-4H3;3*5-8H,1-4H3;2*5-6H,1-4H3.
What are the key properties of 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene?
9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene has a molecular weight of 2631.85 g/mol, XLogP of 58.30, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-bis(3,4-dimethylphenyl)anthracene;1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1,2,3,4-tetramethylbenzene;1,2,4,5-tetramethylbenzene;2,3,6,7-tetramethyl-9,10-diphenylanthracene;1,2,5,6-tetramethylnaphthalene;1,4,5,8-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene;2,3,8,9-tetramethylperylene;3,4,9,10-tetramethylperylene is sourced from PubChem (CID 158936790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).