11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene

C32H24O2 — CID 53474059

IUPAC11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene
SMILESCOc1ccc(C(=C2c3ccccc3-c3cc4ccccc4cc32)c2ccc(OC)cc2)cc1
InChIInChI=1S/C32H24O2/c1-33-25-15-11-21(12-16-25)31(22-13-17-26(34-2)18-14-22)32-28-10-6-5-9-27(28)29-19-23-7-3-4-8-24(23)20-30(29)32/h3-20H,1-2H3
InChIKeyUSZZGKAWCLFBQN-UHFFFAOYSA-N
MW440.54 g/mol
LogP7.84
Rot. Bonds4

About 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene

11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene (PubChem CID 53474059) has the molecular formula C32H24O2 and a molecular weight of 440.54 g/mol. Its IUPAC name is 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene.

Molecular Properties

Compound Name11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene
PubChem CID53474059
Molecular FormulaC32H24O2
Molecular Weight440.54 g/mol
Exact Mass440.18
IUPAC Name11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene
SMILESCOc1ccc(C(=C2c3ccccc3-c3cc4ccccc4cc32)c2ccc(OC)cc2)cc1
InChIInChI=1S/C32H24O2/c1-33-25-15-11-21(12-16-25)31(22-13-17-26(34-2)18-14-22)32-28-10-6-5-9-27(28)29-19-23-7-3-4-8-24(23)20-30(29)32/h3-20H,1-2H3
InChIKeyUSZZGKAWCLFBQN-UHFFFAOYSA-N
XLogP7.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.54
LogP ≤ 57.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(4-methoxyphenyl)-phenylmethylidene]cyclopropa[b]naphthalene
CID 11461778
4-[cyclopropa[b]naphthalen-1-ylidene(phenyl)methyl]phenol
CID 11427189
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
6,13-bis[bis(3,4-dimethoxyphenyl)methylidene]pentacene
CID 156694270
4-methoxy-2-methyl-1-(2-methylphenyl)benzene
CID 12981832
4-[4-(2-hydroxy-4-methoxyphenyl)-6-(2-hydroxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol
CID 136946080
CID 10611515
CID 10611515
(3Z)-1-benzyl-3-[(4-methoxyphenyl)-phenylmethylidene]indol-2-one
CID 101359125
(4-methoxyphenyl)-(5-oxodibenzothiophen-3-yl)methanone
CID 165129256
9-benzhydrylidene-2-ethynylfluorene
CID 101435215
naphthalen-2-yl 4-methoxybenzoate
CID 532400
1-methoxy-4-[phenyl(sulfonyl)methyl]benzene
CID 134894682

Frequently Asked Questions

What is the IUPAC name of 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene?
The IUPAC name of 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene (CID 53474059) is 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene.
What is the SMILES notation for 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene?
The canonical SMILES for 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene is COc1ccc(C(=C2c3ccccc3-c3cc4ccccc4cc32)c2ccc(OC)cc2)cc1.
What is the InChIKey of 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene?
The InChIKey is USZZGKAWCLFBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24O2/c1-33-25-15-11-21(12-16-25)31(22-13-17-26(34-2)18-14-22)32-28-10-6-5-9-27(28)29-19-23-7-3-4-8-24(23)20-30(29)32/h3-20H,1-2H3.
What are the key properties of 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene?
11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene has a molecular weight of 440.54 g/mol, XLogP of 7.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[bis(4-methoxyphenyl)methylidene]benzo[b]fluorene is sourced from PubChem (CID 53474059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).