4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene

C32H30 — CID 145306340

IUPAC4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene
SMILESCCC(C)=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1C
InChIInChI=1S/C32H30/c1-5-22(2)24(4)26-18-13-21-30-31(26)27-17-10-12-20-29(27)32(30,25-15-7-6-8-16-25)28-19-11-9-14-23(28)3/h6-21H,5H2,1-4H3
InChIKeyMGKDJUREPLEPLJ-UHFFFAOYSA-N
MW414.59 g/mol
LogP8.56
Rot. Bonds4

About 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene

4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene (PubChem CID 145306340) has the molecular formula C32H30 and a molecular weight of 414.59 g/mol. Its IUPAC name is 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene.

Molecular Properties

Compound Name4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene
PubChem CID145306340
Molecular FormulaC32H30
Molecular Weight414.59 g/mol
Exact Mass414.23
IUPAC Name4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene
SMILESCCC(C)=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1C
InChIInChI=1S/C32H30/c1-5-22(2)24(4)26-18-13-21-30-31(26)27-17-10-12-20-29(27)32(30,25-15-7-6-8-16-25)28-19-11-9-14-23(28)3/h6-21H,5H2,1-4H3
InChIKeyMGKDJUREPLEPLJ-UHFFFAOYSA-N
XLogP8.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.59
LogP ≤ 58.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-9-(2-methylphenyl)-9-phenylfluorene
CID 145360950
4-methyl-9,9-diphenylfluorene
CID 123595050
N-[(E)-1-[4-methyl-3-[(E)-2-methyl-1-[2-(5,8,10-trimethyl-5,6,9,10-tetrahydrobenzo[8]annulen-7-yl)phenyl]pent-1-enyl]phenyl]pent-1-enyl]-1-phenylethanimine;4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene
CID 145306338
3-[9,9-bis(2-methylphenyl)fluoren-4-yl]but-3-enenitrile
CID 161443765
1-(9,9-diphenylfluoren-4-yl)-N-(1-phenylethenyl)ethanimine
CID 178165620
2-methyl-6-[(Z)-3-methylpent-2-en-2-yl]phenol
CID 20676610
4'-methyl-9,9'-spirobi[fluorene]
CID 91359179
9,9-bis(4-amino-3,5-diethylphenyl)fluorene-4-carboxylic acid
CID 139612538
9,9-diphenylfluorene;propane
CID 158205050
9,9,18,18,27,27-hexakis-phenylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 59217347
4'-[(5E,7Z)-6-ethyl-2,8-dimethyl-7-phenyldeca-2,5,7-trien-5-yl]-9,9'-spirobi[fluorene]
CID 145306498
(9,9-diphenylfluoren-4-yl)boronic acid
CID 119081433

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene?
The IUPAC name of 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene (CID 145306340) is 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene.
What is the SMILES notation for 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene?
The canonical SMILES for 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene is CCC(C)=C(C)c1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccccc1C.
What is the InChIKey of 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene?
The InChIKey is MGKDJUREPLEPLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30/c1-5-22(2)24(4)26-18-13-21-30-31(26)27-17-10-12-20-29(27)32(30,25-15-7-6-8-16-25)28-19-11-9-14-23(28)3/h6-21H,5H2,1-4H3.
What are the key properties of 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene?
4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene has a molecular weight of 414.59 g/mol, XLogP of 8.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylpent-2-en-2-yl)-9-(2-methylphenyl)-9-phenylfluorene is sourced from PubChem (CID 145306340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).