2-deuterio-7-methyl-9,9-diphenylfluorene

C26H20 — CID 59886082

IUPAC2-deuterio-7-methyl-9,9-diphenylfluorene
SMILES[2H]c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)ccc1-2
InChIInChI=1S/C26H20/c1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-18H,1H3/i9D
InChIKeyWKSLTDMYHORGBP-QOWOAITPSA-N
MW333.45 g/mol
LogP6.36
Rot. Bonds2

About 2-deuterio-7-methyl-9,9-diphenylfluorene

2-deuterio-7-methyl-9,9-diphenylfluorene (PubChem CID 59886082) has the molecular formula C26H20 and a molecular weight of 333.45 g/mol. Its IUPAC name is 2-deuterio-7-methyl-9,9-diphenylfluorene.

Molecular Properties

Compound Name2-deuterio-7-methyl-9,9-diphenylfluorene
PubChem CID59886082
Molecular FormulaC26H20
Molecular Weight333.45 g/mol
Exact Mass333.16
IUPAC Name2-deuterio-7-methyl-9,9-diphenylfluorene
SMILES[2H]c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)ccc1-2
InChIInChI=1S/C26H20/c1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-18H,1H3/i9D
InChIKeyWKSLTDMYHORGBP-QOWOAITPSA-N
XLogP6.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.45
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

methane;2-methyl-9,9-diphenylfluorene
CID 144583572
2,7-dimethyl-9,9-diphenylfluorene;3,6-dimethyl-9H-fluorene;2',7'-dimethyl-9,9'-spirobi[fluorene]
CID 157309373
2-methyl-9,9-diphenyl-7-(4-phenylphenyl)fluorene
CID 144950232
2,2',7'-trimethyl-9,9'-spirobi[fluorene]
CID 20807057
N-(4-methylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381203
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;bis(4-methyl-9,9-diphenylfluorene)
CID 160627919
2-methyl-N-[9-(3-methylphenyl)-9-phenylfluoren-2-yl]-N-phenyl-9,9'-spirobi[fluorene]-2'-amine
CID 177067341
CID 58607554
CID 58607554
2-bromo-9-(4-methylphenyl)-9-phenylfluorene
CID 58174872
6,6,12,12-tetrakis(4-methylphenyl)indeno[1,2-b]fluorene
CID 101421308
9-(3-methylphenyl)-9-phenylfluoren-2-amine
CID 142567662
9-[4-(4-methylphenyl)phenyl]-9-phenyl-2,7-bis(4-phenylphenyl)fluorene
CID 58894820

Frequently Asked Questions

What is the IUPAC name of 2-deuterio-7-methyl-9,9-diphenylfluorene?
The IUPAC name of 2-deuterio-7-methyl-9,9-diphenylfluorene (CID 59886082) is 2-deuterio-7-methyl-9,9-diphenylfluorene.
What is the SMILES notation for 2-deuterio-7-methyl-9,9-diphenylfluorene?
The canonical SMILES for 2-deuterio-7-methyl-9,9-diphenylfluorene is [2H]c1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)ccc1-2.
What is the InChIKey of 2-deuterio-7-methyl-9,9-diphenylfluorene?
The InChIKey is WKSLTDMYHORGBP-QOWOAITPSA-N. The full InChI is InChI=1S/C26H20/c1-19-16-17-23-22-14-8-9-15-24(22)26(25(23)18-19,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-18H,1H3/i9D.
What are the key properties of 2-deuterio-7-methyl-9,9-diphenylfluorene?
2-deuterio-7-methyl-9,9-diphenylfluorene has a molecular weight of 333.45 g/mol, XLogP of 6.36, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-deuterio-7-methyl-9,9-diphenylfluorene is sourced from PubChem (CID 59886082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).