4,4-difluoro-7-methyl-2,3-dihydrochromene

C10H10F2O — CID 84718817

IUPAC4,4-difluoro-7-methyl-2,3-dihydrochromene
SMILESCc1ccc2c(c1)OCCC2(F)F
InChIInChI=1S/C10H10F2O/c1-7-2-3-8-9(6-7)13-5-4-10(8,11)12/h2-3,6H,4-5H2,1H3
InChIKeyDFZXYMJNEYJSKC-UHFFFAOYSA-N
MW184.19 g/mol
LogP2.87
Rot. Bonds

About 4,4-difluoro-7-methyl-2,3-dihydrochromene

4,4-difluoro-7-methyl-2,3-dihydrochromene (PubChem CID 84718817) has the molecular formula C10H10F2O and a molecular weight of 184.19 g/mol. Its IUPAC name is 4,4-difluoro-7-methyl-2,3-dihydrochromene.

Molecular Properties

Compound Name4,4-difluoro-7-methyl-2,3-dihydrochromene
PubChem CID84718817
Molecular FormulaC10H10F2O
Molecular Weight184.19 g/mol
Exact Mass184.07
IUPAC Name4,4-difluoro-7-methyl-2,3-dihydrochromene
SMILESCc1ccc2c(c1)OCCC2(F)F
InChIInChI=1S/C10H10F2O/c1-7-2-3-8-9(6-7)13-5-4-10(8,11)12/h2-3,6H,4-5H2,1H3
InChIKeyDFZXYMJNEYJSKC-UHFFFAOYSA-N
XLogP2.87
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 ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-7-methyl-2,3-dihydrochromene?
The IUPAC name of 4,4-difluoro-7-methyl-2,3-dihydrochromene (CID 84718817) is 4,4-difluoro-7-methyl-2,3-dihydrochromene.
What is the SMILES notation for 4,4-difluoro-7-methyl-2,3-dihydrochromene?
The canonical SMILES for 4,4-difluoro-7-methyl-2,3-dihydrochromene is Cc1ccc2c(c1)OCCC2(F)F.
What is the InChIKey of 4,4-difluoro-7-methyl-2,3-dihydrochromene?
The InChIKey is DFZXYMJNEYJSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O/c1-7-2-3-8-9(6-7)13-5-4-10(8,11)12/h2-3,6H,4-5H2,1H3.
What are the key properties of 4,4-difluoro-7-methyl-2,3-dihydrochromene?
4,4-difluoro-7-methyl-2,3-dihydrochromene has a molecular weight of 184.19 g/mol, XLogP of 2.87, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-7-methyl-2,3-dihydrochromene is sourced from PubChem (CID 84718817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).