4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene

C15H16O — CID 56996141

IUPAC4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene
SMILESCC1(C)C=COC2C=c3ccccc3=CC21
InChIInChI=1S/C15H16O/c1-15(2)7-8-16-14-10-12-6-4-3-5-11(12)9-13(14)15/h3-10,13-14H,1-2H3
InChIKeySHXSXJOJWFHPGF-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.82
Rot. Bonds

About 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene

4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene (PubChem CID 56996141) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene.

Molecular Properties

Compound Name4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene
PubChem CID56996141
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene
SMILESCC1(C)C=COC2C=c3ccccc3=CC21
InChIInChI=1S/C15H16O/c1-15(2)7-8-16-14-10-12-6-4-3-5-11(12)9-13(14)15/h3-10,13-14H,1-2H3
InChIKeySHXSXJOJWFHPGF-UHFFFAOYSA-N
XLogP1.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene?
The IUPAC name of 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene (CID 56996141) is 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene.
What is the SMILES notation for 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene?
The canonical SMILES for 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene is CC1(C)C=COC2C=c3ccccc3=CC21.
What is the InChIKey of 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene?
The InChIKey is SHXSXJOJWFHPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-15(2)7-8-16-14-10-12-6-4-3-5-11(12)9-13(14)15/h3-10,13-14H,1-2H3.
What are the key properties of 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene?
4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene has a molecular weight of 212.29 g/mol, XLogP of 1.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-4a,10a-dihydrobenzo[g]chromene is sourced from PubChem (CID 56996141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).