2,2-difluoro-8-methyl-3,4-dihydrochromene

C10H10F2O — CID 118474888

IUPAC2,2-difluoro-8-methyl-3,4-dihydrochromene
SMILESCc1cccc2c1OC(F)(F)CC2
InChIInChI=1S/C10H10F2O/c1-7-3-2-4-8-5-6-10(11,12)13-9(7)8/h2-4H,5-6H2,1H3
InChIKeyJHVUDUUYJXMQNI-UHFFFAOYSA-N
MW184.19 g/mol
LogP2.91
Rot. Bonds

About 2,2-difluoro-8-methyl-3,4-dihydrochromene

2,2-difluoro-8-methyl-3,4-dihydrochromene (PubChem CID 118474888) has the molecular formula C10H10F2O and a molecular weight of 184.19 g/mol. Its IUPAC name is 2,2-difluoro-8-methyl-3,4-dihydrochromene.

Molecular Properties

Compound Name2,2-difluoro-8-methyl-3,4-dihydrochromene
PubChem CID118474888
Molecular FormulaC10H10F2O
Molecular Weight184.19 g/mol
Exact Mass184.07
IUPAC Name2,2-difluoro-8-methyl-3,4-dihydrochromene
SMILESCc1cccc2c1OC(F)(F)CC2
InChIInChI=1S/C10H10F2O/c1-7-3-2-4-8-5-6-10(11,12)13-9(7)8/h2-4H,5-6H2,1H3
InChIKeyJHVUDUUYJXMQNI-UHFFFAOYSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-8-methyl-3,4-dihydrochromene?
The IUPAC name of 2,2-difluoro-8-methyl-3,4-dihydrochromene (CID 118474888) is 2,2-difluoro-8-methyl-3,4-dihydrochromene.
What is the SMILES notation for 2,2-difluoro-8-methyl-3,4-dihydrochromene?
The canonical SMILES for 2,2-difluoro-8-methyl-3,4-dihydrochromene is Cc1cccc2c1OC(F)(F)CC2.
What is the InChIKey of 2,2-difluoro-8-methyl-3,4-dihydrochromene?
The InChIKey is JHVUDUUYJXMQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O/c1-7-3-2-4-8-5-6-10(11,12)13-9(7)8/h2-4H,5-6H2,1H3.
What are the key properties of 2,2-difluoro-8-methyl-3,4-dihydrochromene?
2,2-difluoro-8-methyl-3,4-dihydrochromene has a molecular weight of 184.19 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-8-methyl-3,4-dihydrochromene is sourced from PubChem (CID 118474888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).