[3-(difluoromethoxy)phenyl]methanol

C8H8F2O2 — CID 2736994

IUPAC[3-(difluoromethoxy)phenyl]methanol
SMILESOCc1cccc(OC(F)F)c1
InChIInChI=1S/C8H8F2O2/c9-8(10)12-7-3-1-2-6(4-7)5-11/h1-4,8,11H,5H2
InChIKeyBBDUCPSYPRGPGO-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.78
Rot. Bonds3

About [3-(difluoromethoxy)phenyl]methanol

[3-(difluoromethoxy)phenyl]methanol (PubChem CID 2736994) has the molecular formula C8H8F2O2 and a molecular weight of 174.15 g/mol. Its IUPAC name is [3-(difluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-(difluoromethoxy)phenyl]methanol
PubChem CID2736994
Molecular FormulaC8H8F2O2
Molecular Weight174.15 g/mol
Exact Mass174.05
IUPAC Name[3-(difluoromethoxy)phenyl]methanol
SMILESOCc1cccc(OC(F)F)c1
InChIInChI=1S/C8H8F2O2/c9-8(10)12-7-3-1-2-6(4-7)5-11/h1-4,8,11H,5H2
InChIKeyBBDUCPSYPRGPGO-UHFFFAOYSA-N
XLogP1.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-[[4-(difluoromethoxy)phenyl]methoxy]phenyl]methanol
CID 111770249
[4-[[3-(difluoromethoxy)phenyl]methylsulfinylmethyl]phenyl]methanol
CID 110004994
N-[[3-(difluoromethoxy)phenyl]methyl]hydroxylamine
CID 117281301
2-[3-(difluoromethoxy)phenyl]ethanamine
CID 45091388
[3-(3-methylbutan-2-yloxy)phenyl]methanol
CID 89173621
[3-[1-[3-(difluoromethoxy)phenyl]ethylamino]phenyl]methanol
CID 43714977
2-[3-(difluoromethoxy)phenyl]acetonitrile
CID 2737017
2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
CID 110879156
2-[[3-(difluoromethoxy)phenyl]methyl]guanidine;hydroiodide
CID 110930301
[3-(fluoromethoxy)phenyl]methanol
CID 130445893
1-(difluoromethoxy)-3-(2-phenoxypropyl)benzene
CID 145445557
(3-methoxyphenyl)(113C)methanol
CID 11593446

Frequently Asked Questions

What is the IUPAC name of [3-(difluoromethoxy)phenyl]methanol?
The IUPAC name of [3-(difluoromethoxy)phenyl]methanol (CID 2736994) is [3-(difluoromethoxy)phenyl]methanol.
What is the SMILES notation for [3-(difluoromethoxy)phenyl]methanol?
The canonical SMILES for [3-(difluoromethoxy)phenyl]methanol is OCc1cccc(OC(F)F)c1.
What is the InChIKey of [3-(difluoromethoxy)phenyl]methanol?
The InChIKey is BBDUCPSYPRGPGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2O2/c9-8(10)12-7-3-1-2-6(4-7)5-11/h1-4,8,11H,5H2.
What are the key properties of [3-(difluoromethoxy)phenyl]methanol?
[3-(difluoromethoxy)phenyl]methanol has a molecular weight of 174.15 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(difluoromethoxy)phenyl]methanol is sourced from PubChem (CID 2736994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).