7-(difluoromethyl)-1-methylnaphthalene

C12H10F2 — CID 118843150

IUPAC7-(difluoromethyl)-1-methylnaphthalene
SMILESCc1cccc2ccc(C(F)F)cc12
InChIInChI=1S/C12H10F2/c1-8-3-2-4-9-5-6-10(12(13)14)7-11(8)9/h2-7,12H,1H3
InChIKeyWJVFXKLWZJHLAE-UHFFFAOYSA-N
MW192.21 g/mol
LogP4.09
Rot. Bonds1

About 7-(difluoromethyl)-1-methylnaphthalene

7-(difluoromethyl)-1-methylnaphthalene (PubChem CID 118843150) has the molecular formula C12H10F2 and a molecular weight of 192.21 g/mol. Its IUPAC name is 7-(difluoromethyl)-1-methylnaphthalene.

Molecular Properties

Compound Name7-(difluoromethyl)-1-methylnaphthalene
PubChem CID118843150
Molecular FormulaC12H10F2
Molecular Weight192.21 g/mol
Exact Mass192.08
IUPAC Name7-(difluoromethyl)-1-methylnaphthalene
SMILESCc1cccc2ccc(C(F)F)cc12
InChIInChI=1S/C12H10F2/c1-8-3-2-4-9-5-6-10(12(13)14)7-11(8)9/h2-7,12H,1H3
InChIKeyWJVFXKLWZJHLAE-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethyl)-1-methylnaphthalene?
The IUPAC name of 7-(difluoromethyl)-1-methylnaphthalene (CID 118843150) is 7-(difluoromethyl)-1-methylnaphthalene.
What is the SMILES notation for 7-(difluoromethyl)-1-methylnaphthalene?
The canonical SMILES for 7-(difluoromethyl)-1-methylnaphthalene is Cc1cccc2ccc(C(F)F)cc12.
What is the InChIKey of 7-(difluoromethyl)-1-methylnaphthalene?
The InChIKey is WJVFXKLWZJHLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2/c1-8-3-2-4-9-5-6-10(12(13)14)7-11(8)9/h2-7,12H,1H3.
What are the key properties of 7-(difluoromethyl)-1-methylnaphthalene?
7-(difluoromethyl)-1-methylnaphthalene has a molecular weight of 192.21 g/mol, XLogP of 4.09, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(difluoromethyl)-1-methylnaphthalene is sourced from PubChem (CID 118843150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).