2,2,5,6-tetramethylbenzo[h]chromene

C17H18O — CID 21339666

IUPAC2,2,5,6-tetramethylbenzo[h]chromene
SMILESCc1c2c(c3ccccc3c1C)OC(C)(C)C=C2
InChIInChI=1S/C17H18O/c1-11-12(2)14-9-10-17(3,4)18-16(14)15-8-6-5-7-13(11)15/h5-10H,1-4H3
InChIKeyIFOHNLNGBXFZIQ-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.64
Rot. Bonds

About 2,2,5,6-tetramethylbenzo[h]chromene

2,2,5,6-tetramethylbenzo[h]chromene (PubChem CID 21339666) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2,2,5,6-tetramethylbenzo[h]chromene.

Molecular Properties

Compound Name2,2,5,6-tetramethylbenzo[h]chromene
PubChem CID21339666
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name2,2,5,6-tetramethylbenzo[h]chromene
SMILESCc1c2c(c3ccccc3c1C)OC(C)(C)C=C2
InChIInChI=1S/C17H18O/c1-11-12(2)14-9-10-17(3,4)18-16(14)15-8-6-5-7-13(11)15/h5-10H,1-4H3
InChIKeyIFOHNLNGBXFZIQ-UHFFFAOYSA-N
XLogP4.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2,5,6-tetramethylbenzo[h]chromene?
The IUPAC name of 2,2,5,6-tetramethylbenzo[h]chromene (CID 21339666) is 2,2,5,6-tetramethylbenzo[h]chromene.
What is the SMILES notation for 2,2,5,6-tetramethylbenzo[h]chromene?
The canonical SMILES for 2,2,5,6-tetramethylbenzo[h]chromene is Cc1c2c(c3ccccc3c1C)OC(C)(C)C=C2.
What is the InChIKey of 2,2,5,6-tetramethylbenzo[h]chromene?
The InChIKey is IFOHNLNGBXFZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-11-12(2)14-9-10-17(3,4)18-16(14)15-8-6-5-7-13(11)15/h5-10H,1-4H3.
What are the key properties of 2,2,5,6-tetramethylbenzo[h]chromene?
2,2,5,6-tetramethylbenzo[h]chromene has a molecular weight of 238.33 g/mol, XLogP of 4.64, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,6-tetramethylbenzo[h]chromene is sourced from PubChem (CID 21339666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).