11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene

C30H24 — CID 123864215

IUPAC11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene
SMILESCc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4ccccc4cc2-3)c2ccccc12
InChIInChI=1S/C30H24/c1-19-12-14-24(25-11-7-6-10-23(19)25)22-13-15-26-27-16-20-8-4-5-9-21(20)17-29(27)30(2,3)28(26)18-22/h4-18H,1-3H3
InChIKeyVYWBFYXPHJKRAZ-UHFFFAOYSA-N
MW384.52 g/mol
LogP8.27
Rot. Bonds1

About 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene

11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene (PubChem CID 123864215) has the molecular formula C30H24 and a molecular weight of 384.52 g/mol. Its IUPAC name is 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene.

Molecular Properties

Compound Name11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene
PubChem CID123864215
Molecular FormulaC30H24
Molecular Weight384.52 g/mol
Exact Mass384.19
IUPAC Name11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene
SMILESCc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4ccccc4cc2-3)c2ccccc12
InChIInChI=1S/C30H24/c1-19-12-14-24(25-11-7-6-10-23(19)25)22-13-15-26-27-16-20-8-4-5-9-21(20)17-29(27)30(2,3)28(26)18-22/h4-18H,1-3H3
InChIKeyVYWBFYXPHJKRAZ-UHFFFAOYSA-N
XLogP8.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.52
LogP ≤ 58.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)naphthalen-1-yl]-4,6-diphenylpyrimidine
CID 168778998
10,10-dimethyl-7,17-bis(4-phenylnaphthalen-1-yl)pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaene
CID 58175520
9-(9,9-dimethyl-7-phenanthren-9-ylfluoren-2-yl)phenanthrene
CID 58883838
2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)naphthalen-1-yl]-4-(9,9-dimethylfluoren-2-yl)-6-phenylpyrimidine
CID 168779140
2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)naphthalen-1-yl]-4-(2-phenylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 168779406
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)naphthalen-1-yl]-6-(3,5-diphenylphenyl)-2-phenylpyrimidine
CID 168778849
2-[4-[3-(11,11-dimethylbenzo[b]fluoren-2-yl)phenyl]naphthalen-1-yl]-4-naphthalen-2-yl-6-phenylpyrimidine
CID 168777582
2-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)naphthalen-1-yl]-4-naphthalen-1-yl-6-(4-phenylphenyl)pyrimidine
CID 168777428
9,9-dimethyl-7-naphthalen-1-ylfluoren-2-amine
CID 121321735
9-[9,9-dimethyl-7-(7,9,9-trimethylfluoren-2-yl)fluoren-2-yl]phenanthrene
CID 143227241
1,9,9-trimethyl-7-naphthalen-1-ylfluorene
CID 156896552

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene?
The IUPAC name of 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene (CID 123864215) is 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene.
What is the SMILES notation for 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene?
The canonical SMILES for 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene is Cc1ccc(-c2ccc3c(c2)C(C)(C)c2cc4ccccc4cc2-3)c2ccccc12.
What is the InChIKey of 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene?
The InChIKey is VYWBFYXPHJKRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24/c1-19-12-14-24(25-11-7-6-10-23(19)25)22-13-15-26-27-16-20-8-4-5-9-21(20)17-29(27)30(2,3)28(26)18-22/h4-18H,1-3H3.
What are the key properties of 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene?
11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene has a molecular weight of 384.52 g/mol, XLogP of 8.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-2-(4-methylnaphthalen-1-yl)benzo[b]fluorene is sourced from PubChem (CID 123864215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).