3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol

C10H10F2O2 — CID 79335695

IUPAC3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol
SMILESOCC=Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H10F2O2/c11-10(12)14-9-5-3-8(4-6-9)2-1-7-13/h1-6,10,13H,7H2
InChIKeyXQCSWOBGTCBTOW-UHFFFAOYSA-N
MW200.18 g/mol
LogP2.29
Rot. Bonds4

About 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol

3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol (PubChem CID 79335695) has the molecular formula C10H10F2O2 and a molecular weight of 200.18 g/mol. Its IUPAC name is 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol.

Molecular Properties

Compound Name3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol
PubChem CID79335695
Molecular FormulaC10H10F2O2
Molecular Weight200.18 g/mol
Exact Mass200.06
IUPAC Name3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol
SMILESOCC=Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H10F2O2/c11-10(12)14-9-5-3-8(4-6-9)2-1-7-13/h1-6,10,13H,7H2
InChIKeyXQCSWOBGTCBTOW-UHFFFAOYSA-N
XLogP2.29
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.18
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(difluoromethoxy)benzaldehyde
CID 2736986
methyl (E)-3-[4-(difluoromethoxy)phenyl]prop-2-enoate
CID 78906321
(E)-3-[4-(3-methylbutoxy)phenyl]prop-2-en-1-ol
CID 70597845
3-[4-[(4-fluorophenyl)methoxy]phenyl]prop-2-en-1-ol
CID 169454334
5-[(Z)-2-[4-(difluoromethoxy)phenyl]ethenyl]-1,2,3-trimethoxybenzene
CID 137454170
[2-(methylamino)-2-oxoethyl] (E)-3-[4-(difluoromethoxy)phenyl]prop-2-enoate
CID 6212532
(2E,4E)-5-(4-methoxyphenyl)penta-2,4-dien-1-ol
CID 2253109
3-[4-(2-ethenoxyethoxy)phenyl]prop-2-en-1-ol
CID 123795084
2-[4-(difluoromethoxy)phenyl]ethanol;ethane
CID 142357995
(4-acetylphenyl) 3-[4-(difluoromethoxy)phenyl]prop-2-enoate
CID 4813382
3-[4-(difluoromethoxy)phenyl]-N-(1-methoxypropan-2-yl)prop-2-enamide
CID 73422099
methyl 4-[3-[4-(difluoromethoxy)phenyl]-3-oxoprop-1-enyl]benzoate
CID 4811100

Frequently Asked Questions

What is the IUPAC name of 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol?
The IUPAC name of 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol (CID 79335695) is 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol.
What is the SMILES notation for 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol?
The canonical SMILES for 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol is OCC=Cc1ccc(OC(F)F)cc1.
What is the InChIKey of 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol?
The InChIKey is XQCSWOBGTCBTOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O2/c11-10(12)14-9-5-3-8(4-6-9)2-1-7-13/h1-6,10,13H,7H2.
What are the key properties of 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol?
3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol has a molecular weight of 200.18 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(difluoromethoxy)phenyl]prop-2-en-1-ol is sourced from PubChem (CID 79335695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).