(2R)-3,3,3-trifluoro-2-iodopropan-1-ol

C3H4F3IO — CID 126560574

IUPAC(2R)-3,3,3-trifluoro-2-iodopropan-1-ol
SMILESOC[C@@H](I)C(F)(F)F
InChIInChI=1S/C3H4F3IO/c4-3(5,6)2(7)1-8/h2,8H,1H2/t2-/m1/s1
InChIKeyWUJMRXQNKCDSGE-UWTATZPHSA-N
MW239.96 g/mol
LogP1.34
Rot. Bonds1

About (2R)-3,3,3-trifluoro-2-iodopropan-1-ol

(2R)-3,3,3-trifluoro-2-iodopropan-1-ol (PubChem CID 126560574) has the molecular formula C3H4F3IO and a molecular weight of 239.96 g/mol. Its IUPAC name is (2R)-3,3,3-trifluoro-2-iodopropan-1-ol.

Molecular Properties

Compound Name(2R)-3,3,3-trifluoro-2-iodopropan-1-ol
PubChem CID126560574
Molecular FormulaC3H4F3IO
Molecular Weight239.96 g/mol
Exact Mass239.93
IUPAC Name(2R)-3,3,3-trifluoro-2-iodopropan-1-ol
SMILESOC[C@@H](I)C(F)(F)F
InChIInChI=1S/C3H4F3IO/c4-3(5,6)2(7)1-8/h2,8H,1H2/t2-/m1/s1
InChIKeyWUJMRXQNKCDSGE-UWTATZPHSA-N
XLogP1.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.96
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3,3,3-trifluoro-2-methylpropan-1-ol
CID 10148993
(4S)-1,1,1,5,5,5-hexafluoropentane-2,4-diol
CID 135017833
1,1,1,4,4,4-hexafluoro-2,3-diiodobutane
CID 139684738
2,3-diiodobutane-1,4-diol
CID 134177181
(2R)-3-methyl-2-(trifluoromethyl)butan-1-ol
CID 88612576
tris(1,1,1,5,5,5-hexafluoropentane-2,4-diol);zinc
CID 5231417
1,1,3-trifluoro-1,2-diiodopropane
CID 175825475
2-amino-6,6,6-trifluorohexane-1,5-diol;hydrochloride
CID 90120224
methyl 3,3,3-trifluoro-2-(hydroxymethyl)propanoate
CID 84717436
(2R,3R)-4,4-difluoro-4-iodobutane-1,2,3-triol
CID 162586330
(2S,3R,4R)-5,5,5-trifluoropentane-1,2,3,4-tetrol
CID 122371749
3,3,3-trifluoro-2-[methyl(2-methylpropyl)amino]propan-1-ol
CID 154957561

Frequently Asked Questions

What is the IUPAC name of (2R)-3,3,3-trifluoro-2-iodopropan-1-ol?
The IUPAC name of (2R)-3,3,3-trifluoro-2-iodopropan-1-ol (CID 126560574) is (2R)-3,3,3-trifluoro-2-iodopropan-1-ol.
What is the SMILES notation for (2R)-3,3,3-trifluoro-2-iodopropan-1-ol?
The canonical SMILES for (2R)-3,3,3-trifluoro-2-iodopropan-1-ol is OC[C@@H](I)C(F)(F)F.
What is the InChIKey of (2R)-3,3,3-trifluoro-2-iodopropan-1-ol?
The InChIKey is WUJMRXQNKCDSGE-UWTATZPHSA-N. The full InChI is InChI=1S/C3H4F3IO/c4-3(5,6)2(7)1-8/h2,8H,1H2/t2-/m1/s1.
What are the key properties of (2R)-3,3,3-trifluoro-2-iodopropan-1-ol?
(2R)-3,3,3-trifluoro-2-iodopropan-1-ol has a molecular weight of 239.96 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3,3,3-trifluoro-2-iodopropan-1-ol is sourced from PubChem (CID 126560574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).