1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene

C10H10F2O — CID 121234773

IUPAC1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene
SMILESCc1ccccc1OC1CC1(F)F
InChIInChI=1S/C10H10F2O/c1-7-4-2-3-5-8(7)13-9-6-10(9,11)12/h2-5,9H,6H2,1H3
InChIKeyOPMWARALSVLKJW-UHFFFAOYSA-N
MW184.19 g/mol
LogP2.78
Rot. Bonds2

About 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene

1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene (PubChem CID 121234773) has the molecular formula C10H10F2O and a molecular weight of 184.19 g/mol. Its IUPAC name is 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene.

Molecular Properties

Compound Name1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene
PubChem CID121234773
Molecular FormulaC10H10F2O
Molecular Weight184.19 g/mol
Exact Mass184.07
IUPAC Name1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene
SMILESCc1ccccc1OC1CC1(F)F
InChIInChI=1S/C10H10F2O/c1-7-4-2-3-5-8(7)13-9-6-10(9,11)12/h2-5,9H,6H2,1H3
InChIKeyOPMWARALSVLKJW-UHFFFAOYSA-N
XLogP2.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene?
The IUPAC name of 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene (CID 121234773) is 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene.
What is the SMILES notation for 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene?
The canonical SMILES for 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene is Cc1ccccc1OC1CC1(F)F.
What is the InChIKey of 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene?
The InChIKey is OPMWARALSVLKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O/c1-7-4-2-3-5-8(7)13-9-6-10(9,11)12/h2-5,9H,6H2,1H3.
What are the key properties of 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene?
1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene has a molecular weight of 184.19 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluorocyclopropyl)oxy-2-methylbenzene is sourced from PubChem (CID 121234773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).