1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol

C11H12F2O — CID 82815611

IUPAC1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol
SMILESCc1ccc(F)c(C2(O)CC2C)c1F
InChIInChI=1S/C11H12F2O/c1-6-3-4-8(12)9(10(6)13)11(14)5-7(11)2/h3-4,7,14H,5H2,1-2H3
InChIKeyOKTGCKQVVHDGSM-UHFFFAOYSA-N
MW198.21 g/mol
LogP2.50
Rot. Bonds1

About 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol

1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol (PubChem CID 82815611) has the molecular formula C11H12F2O and a molecular weight of 198.21 g/mol. Its IUPAC name is 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol
PubChem CID82815611
Molecular FormulaC11H12F2O
Molecular Weight198.21 g/mol
Exact Mass198.09
IUPAC Name1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol
SMILESCc1ccc(F)c(C2(O)CC2C)c1F
InChIInChI=1S/C11H12F2O/c1-6-3-4-8(12)9(10(6)13)11(14)5-7(11)2/h3-4,7,14H,5H2,1-2H3
InChIKeyOKTGCKQVVHDGSM-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.21
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2,6-difluoro-3-methylphenyl)-2,6-dimethyloxan-4-ol
CID 82820329
1-(2,6-difluoro-3-methylphenyl)-3-methylcyclopentan-1-ol
CID 82820086
1-(2,3-difluorophenyl)-2-methylcyclopropan-1-ol
CID 79332533
1-(3-bromo-2,6-difluorophenyl)-2,4,4-trimethylcyclopentan-1-ol
CID 106941537
1-(3-bromo-2,6-difluorophenyl)-2,4,4-trimethylcyclohexan-1-ol
CID 106941425
1-(2,6-difluoro-3-methylphenyl)-2,5-dimethylcyclohexan-1-amine
CID 82820255
1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol
CID 79333022
3-amino-1-(2,6-difluoro-3-methylphenyl)-2,3-dihydroinden-1-ol
CID 107089749
1-(4-fluoro-3-methylphenyl)-2,4,4-trimethylcyclopentan-1-ol
CID 106663637
1-(2,6-difluoro-3-methylphenyl)-2,3-dimethylcyclohexan-1-amine
CID 82820099
4-(2,6-difluoro-3-methylphenyl)-1-propan-2-ylpiperidin-4-ol
CID 82819297
1-(2,6-difluoro-3-methylphenyl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 82803679

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol?
The IUPAC name of 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol (CID 82815611) is 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol.
What is the SMILES notation for 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol?
The canonical SMILES for 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol is Cc1ccc(F)c(C2(O)CC2C)c1F.
What is the InChIKey of 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol?
The InChIKey is OKTGCKQVVHDGSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2O/c1-6-3-4-8(12)9(10(6)13)11(14)5-7(11)2/h3-4,7,14H,5H2,1-2H3.
What are the key properties of 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol?
1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol has a molecular weight of 198.21 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluoro-3-methylphenyl)-2-methylcyclopropan-1-ol is sourced from PubChem (CID 82815611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).