4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene

C15H16F2O — CID 143998626

IUPAC4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene
SMILESCC1=C(F)C2=C(CC1)C1=C(OC2)C(F)=C(C)CC1
InChIInChI=1S/C15H16F2O/c1-8-3-5-10-11-6-4-9(2)14(17)15(11)18-7-12(10)13(8)16/h3-7H2,1-2H3
InChIKeyMMOMIIQWBBFPID-UHFFFAOYSA-N
MW250.29 g/mol
LogP4.64
Rot. Bonds

About 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene

4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene (PubChem CID 143998626) has the molecular formula C15H16F2O and a molecular weight of 250.29 g/mol. Its IUPAC name is 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene.

Molecular Properties

Compound Name4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene
PubChem CID143998626
Molecular FormulaC15H16F2O
Molecular Weight250.29 g/mol
Exact Mass250.12
IUPAC Name4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene
SMILESCC1=C(F)C2=C(CC1)C1=C(OC2)C(F)=C(C)CC1
InChIInChI=1S/C15H16F2O/c1-8-3-5-10-11-6-4-9(2)14(17)15(11)18-7-12(10)13(8)16/h3-7H2,1-2H3
InChIKeyMMOMIIQWBBFPID-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 ≤ 500250.29
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,7-dimethyl-5,6-dihydro-1,3-benzodioxole
CID 143987366
2-fluoro-1,3-dimethyl-4-phenylcyclohexa-1,3-diene
CID 173366752
4,7-dimethyl-2,3,5,6-tetrahydro-1-benzofuran;ethane
CID 144506345
6-fluoro-5-methyl-2-propan-2-ylcyclohexa-1,5-dien-1-ol
CID 172586012
1-methyl-3-(3-methyl-4,5,6,7-tetrahydro-2H-inden-1-yl)-4,5,6,7-tetrahydro-2H-indene
CID 59165315
ethane;4,5,6-trifluoro-3,7-dimethyl-2,9-dihydro-1H-xanthene
CID 144733836
1,2-dimethylcyclopentene;molecular fluorine
CID 157100565
1-bromo-2-methylcyclobutene
CID 45090410
8-methyl-6,7-dihydro-4H-1,3-benzodioxine
CID 89384807
tricyclo[4.3.0.02,7]nona-1,6-diene
CID 149382388
1-fluoro-4-methyl-2,3-dihydronaphthalene
CID 143753613
4-methyl-5-propan-2-ylfuran-3-one
CID 51354983

Frequently Asked Questions

What is the IUPAC name of 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene?
The IUPAC name of 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene (CID 143998626) is 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene.
What is the SMILES notation for 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene?
The canonical SMILES for 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene is CC1=C(F)C2=C(CC1)C1=C(OC2)C(F)=C(C)CC1.
What is the InChIKey of 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene?
The InChIKey is MMOMIIQWBBFPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2O/c1-8-3-5-10-11-6-4-9(2)14(17)15(11)18-7-12(10)13(8)16/h3-7H2,1-2H3.
What are the key properties of 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene?
4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene has a molecular weight of 250.29 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 4,7-difluoro-3,8-dimethyl-2,6,9,10-tetrahydro-1H-benzo[c]chromene is sourced from PubChem (CID 143998626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).