8-(difluoromethyl)-5H-chromene

C10H8F2O — CID 150872108

IUPAC8-(difluoromethyl)-5H-chromene
SMILESFC(F)C1=C2OC=CC=C2CC=C1
InChIInChI=1S/C10H8F2O/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-2,4-6,10H,3H2
InChIKeyKUGFQUVZZJFYLH-UHFFFAOYSA-N
MW182.17 g/mol
LogP2.94
Rot. Bonds1

About 8-(difluoromethyl)-5H-chromene

8-(difluoromethyl)-5H-chromene (PubChem CID 150872108) has the molecular formula C10H8F2O and a molecular weight of 182.17 g/mol. Its IUPAC name is 8-(difluoromethyl)-5H-chromene.

Molecular Properties

Compound Name8-(difluoromethyl)-5H-chromene
PubChem CID150872108
Molecular FormulaC10H8F2O
Molecular Weight182.17 g/mol
Exact Mass182.05
IUPAC Name8-(difluoromethyl)-5H-chromene
SMILESFC(F)C1=C2OC=CC=C2CC=C1
InChIInChI=1S/C10H8F2O/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-2,4-6,10H,3H2
InChIKeyKUGFQUVZZJFYLH-UHFFFAOYSA-N
XLogP2.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.17
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-(difluoromethyl)-5H-chromene?
The IUPAC name of 8-(difluoromethyl)-5H-chromene (CID 150872108) is 8-(difluoromethyl)-5H-chromene.
What is the SMILES notation for 8-(difluoromethyl)-5H-chromene?
The canonical SMILES for 8-(difluoromethyl)-5H-chromene is FC(F)C1=C2OC=CC=C2CC=C1.
What is the InChIKey of 8-(difluoromethyl)-5H-chromene?
The InChIKey is KUGFQUVZZJFYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2O/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-2,4-6,10H,3H2.
What are the key properties of 8-(difluoromethyl)-5H-chromene?
8-(difluoromethyl)-5H-chromene has a molecular weight of 182.17 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(difluoromethyl)-5H-chromene is sourced from PubChem (CID 150872108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).