2-fluoro-3-phenylmethoxypropan-1-ol

C10H13FO2 — CID 14003285

IUPAC2-fluoro-3-phenylmethoxypropan-1-ol
SMILESOCC(F)COCc1ccccc1
InChIInChI=1S/C10H13FO2/c11-10(6-12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2
InChIKeyZBYWMMUOFGLUIO-UHFFFAOYSA-N
MW184.21 g/mol
LogP1.53
Rot. Bonds5

About 2-fluoro-3-phenylmethoxypropan-1-ol

2-fluoro-3-phenylmethoxypropan-1-ol (PubChem CID 14003285) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 2-fluoro-3-phenylmethoxypropan-1-ol.

Molecular Properties

Compound Name2-fluoro-3-phenylmethoxypropan-1-ol
PubChem CID14003285
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name2-fluoro-3-phenylmethoxypropan-1-ol
SMILESOCC(F)COCc1ccccc1
InChIInChI=1S/C10H13FO2/c11-10(6-12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2
InChIKeyZBYWMMUOFGLUIO-UHFFFAOYSA-N
XLogP1.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzyl Alcohol
CID 244
Dibenzyl ether
CID 7657
Benzyl ethyl ether
CID 10873
2-(Benzyloxy) ethanol
CID 12141
Benzyl butyl ether
CID 61134
Benzyl methyl ether
CID 10869
1,4-Bis(Methoxymethyl)Benzene
CID 81239
Allyl benzyl ether
CID 84542
Benzyl octyl ether
CID 347508
2,3-Difluorobenzyl Alcohol
CID 447153
2,4-Difluorobenzyl alcohol
CID 91867
1,4-Benzenedimethanol
CID 11506

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-phenylmethoxypropan-1-ol?
The IUPAC name of 2-fluoro-3-phenylmethoxypropan-1-ol (CID 14003285) is 2-fluoro-3-phenylmethoxypropan-1-ol.
What is the SMILES notation for 2-fluoro-3-phenylmethoxypropan-1-ol?
The canonical SMILES for 2-fluoro-3-phenylmethoxypropan-1-ol is OCC(F)COCc1ccccc1.
What is the InChIKey of 2-fluoro-3-phenylmethoxypropan-1-ol?
The InChIKey is ZBYWMMUOFGLUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c11-10(6-12)8-13-7-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2.
What are the key properties of 2-fluoro-3-phenylmethoxypropan-1-ol?
2-fluoro-3-phenylmethoxypropan-1-ol has a molecular weight of 184.21 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-phenylmethoxypropan-1-ol is sourced from PubChem (CID 14003285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).