[2-(difluoromethoxy)-4,6-difluorophenyl]methanol

C8H6F4O2 — CID 130934755

IUPAC[2-(difluoromethoxy)-4,6-difluorophenyl]methanol
SMILESOCc1c(F)cc(F)cc1OC(F)F
InChIInChI=1S/C8H6F4O2/c9-4-1-6(10)5(3-13)7(2-4)14-8(11)12/h1-2,8,13H,3H2
InChIKeyCQHXGBVXLLPZCW-UHFFFAOYSA-N
MW210.13 g/mol
LogP2.06
Rot. Bonds3

About [2-(difluoromethoxy)-4,6-difluorophenyl]methanol

[2-(difluoromethoxy)-4,6-difluorophenyl]methanol (PubChem CID 130934755) has the molecular formula C8H6F4O2 and a molecular weight of 210.13 g/mol. Its IUPAC name is [2-(difluoromethoxy)-4,6-difluorophenyl]methanol.

Molecular Properties

Compound Name[2-(difluoromethoxy)-4,6-difluorophenyl]methanol
PubChem CID130934755
Molecular FormulaC8H6F4O2
Molecular Weight210.13 g/mol
Exact Mass210.03
IUPAC Name[2-(difluoromethoxy)-4,6-difluorophenyl]methanol
SMILESOCc1c(F)cc(F)cc1OC(F)F
InChIInChI=1S/C8H6F4O2/c9-4-1-6(10)5(3-13)7(2-4)14-8(11)12/h1-2,8,13H,3H2
InChIKeyCQHXGBVXLLPZCW-UHFFFAOYSA-N
XLogP2.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.13
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(chloromethyl)-3-(difluoromethoxy)-5-fluorophenyl]acetic acid
CID 171021492
1-(difluoromethoxy)-2,4-difluorobenzene
CID 18344090
[3-bromo-6-(difluoromethoxy)-2-fluorophenyl]methanol
CID 118141988
[4-(difluoromethyl)-2,6-difluorophenyl]methanol
CID 131189605
[3-(difluoromethoxy)-2,5-difluorophenyl]boronic acid
CID 171030320
1-(2,3,5-trifluorophenoxy)ethanol
CID 143423169
[2-(difluoromethoxy)naphthalen-1-yl]methanol
CID 43394581
2-(chloromethyl)-6-(difluoromethoxy)-4-fluorobenzoic acid
CID 171022135
2-[2-(difluoromethoxy)-6-fluoro-4-nitrophenyl]acetic acid
CID 171032004
methyl 2-[4-(bromomethyl)-2-(difluoromethoxy)-6-fluorophenyl]acetate
CID 171017876
[4-(difluoromethoxy)phenyl]-(2,4,6-trifluorophenyl)methanol
CID 61087299
2-[2-cyano-3-(difluoromethoxy)-5-fluorophenyl]acetic acid
CID 119017382

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)-4,6-difluorophenyl]methanol?
The IUPAC name of [2-(difluoromethoxy)-4,6-difluorophenyl]methanol (CID 130934755) is [2-(difluoromethoxy)-4,6-difluorophenyl]methanol.
What is the SMILES notation for [2-(difluoromethoxy)-4,6-difluorophenyl]methanol?
The canonical SMILES for [2-(difluoromethoxy)-4,6-difluorophenyl]methanol is OCc1c(F)cc(F)cc1OC(F)F.
What is the InChIKey of [2-(difluoromethoxy)-4,6-difluorophenyl]methanol?
The InChIKey is CQHXGBVXLLPZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F4O2/c9-4-1-6(10)5(3-13)7(2-4)14-8(11)12/h1-2,8,13H,3H2.
What are the key properties of [2-(difluoromethoxy)-4,6-difluorophenyl]methanol?
[2-(difluoromethoxy)-4,6-difluorophenyl]methanol has a molecular weight of 210.13 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)-4,6-difluorophenyl]methanol is sourced from PubChem (CID 130934755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).