2-ethyl-1,3,7-trimethylfluoren-9-one

C18H18O — CID 101404814

IUPAC2-ethyl-1,3,7-trimethylfluoren-9-one
SMILESCCc1c(C)cc2c(c1C)C(=O)c1cc(C)ccc1-2
InChIInChI=1S/C18H18O/c1-5-13-11(3)9-15-14-7-6-10(2)8-16(14)18(19)17(15)12(13)4/h6-9H,5H2,1-4H3
InChIKeyDLLPVCLZYSZQSB-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.39
Rot. Bonds1

About 2-ethyl-1,3,7-trimethylfluoren-9-one

2-ethyl-1,3,7-trimethylfluoren-9-one (PubChem CID 101404814) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-ethyl-1,3,7-trimethylfluoren-9-one.

Molecular Properties

Compound Name2-ethyl-1,3,7-trimethylfluoren-9-one
PubChem CID101404814
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Name2-ethyl-1,3,7-trimethylfluoren-9-one
SMILESCCc1c(C)cc2c(c1C)C(=O)c1cc(C)ccc1-2
InChIInChI=1S/C18H18O/c1-5-13-11(3)9-15-14-7-6-10(2)8-16(14)18(19)17(15)12(13)4/h6-9H,5H2,1-4H3
InChIKeyDLLPVCLZYSZQSB-UHFFFAOYSA-N
XLogP4.39
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,4,7-tetramethylanthracene-9,10-dione
CID 23454169
1-amino-3,7-dimethylfluoren-9-one
CID 15447110
9,14,18,24,29,34-hexamethylnonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.021,26.028,32]tetratriaconta-1(31),2(34),3(16),4(13),5(33),6(11),7,9,14,17,19,21(26),22,24,28(32),29-hexadecaene-12,27-dione;9,14,19,24,30,34-hexamethylnonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6(11),7,9,14,17(31),18,20(32),22(27),23,25,28-hexadecaene-12,21-dione
CID 56620359
1,7-dimethylphenanthrene-9,10-dione;ethane
CID 54539649
3-(3,7-dimethyl-1,4-dioxonaphthalen-2-yl)-2,6-dimethylnaphthalene-1,4-dione
CID 59053380
2-ethyl-3-methyl-1-phenylanthracene-9,10-dione
CID 139627277
2-methyl-7-sulfanylfluoren-9-one
CID 148861091
1,4-dihydroxy-2,7-dimethylanthracene-9,10-dione
CID 102313508
3-ethyl-4-hydroxy-6-methylnaphthalene-1,2-dione
CID 19938835
2-methyl-7-propylanthracene-9,10-dione
CID 118026365
1-amino-4-chloro-2,6-dimethylanthracene-9,10-dione
CID 70527047
5-methylisoindole-1,3-dione;propane
CID 156794481

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,3,7-trimethylfluoren-9-one?
The IUPAC name of 2-ethyl-1,3,7-trimethylfluoren-9-one (CID 101404814) is 2-ethyl-1,3,7-trimethylfluoren-9-one.
What is the SMILES notation for 2-ethyl-1,3,7-trimethylfluoren-9-one?
The canonical SMILES for 2-ethyl-1,3,7-trimethylfluoren-9-one is CCc1c(C)cc2c(c1C)C(=O)c1cc(C)ccc1-2.
What is the InChIKey of 2-ethyl-1,3,7-trimethylfluoren-9-one?
The InChIKey is DLLPVCLZYSZQSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O/c1-5-13-11(3)9-15-14-7-6-10(2)8-16(14)18(19)17(15)12(13)4/h6-9H,5H2,1-4H3.
What are the key properties of 2-ethyl-1,3,7-trimethylfluoren-9-one?
2-ethyl-1,3,7-trimethylfluoren-9-one has a molecular weight of 250.34 g/mol, XLogP of 4.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,3,7-trimethylfluoren-9-one is sourced from PubChem (CID 101404814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).