(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol

Name: (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₈H₁₃F₃O₂ — CID 155439190

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol

SMILESC[C@H](O)C1CC1C[C@H](O)C(F)(F)F

InChIInChI=1S/C8H13F3O2/c1-4(12)6-2-5(6)3-7(13)8(9,10)11/h4-7,12-13H,2-3H2,1H3/t4-,5?,6?,7-/m0/s1

InChIKeyFVSONJQSNCFBCK-SZWNGJMLSA-N

MW198.18 g/mol

LogP1.32

Rot. Bonds3

About (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol

(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol (PubChem CID 155439190) has the molecular formula C₈H₁₃F₃O₂ and a molecular weight of 198.18 g/mol. Its IUPAC name is (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol.

Molecular Properties

Compound Name	(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol
PubChem CID	155439190
Molecular Formula	C₈H₁₃F₃O₂
Molecular Weight	198.18 g/mol
Exact Mass	198.09
IUPAC Name	(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol
SMILES	C[C@H](O)C1CC1C[C@H](O)C(F)(F)F
InChI	InChI=1S/C8H13F3O2/c1-4(12)6-2-5(6)3-7(13)8(9,10)11/h4-7,12-13H,2-3H2,1H3/t4-,5?,6?,7-/m0/s1
InChIKey	FVSONJQSNCFBCK-SZWNGJMLSA-N
XLogP	1.32
TPSA	40.46 Å²
H-Bond Donors	2
H-Bond Acceptors	2
Rotatable Bonds	3
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	198.18
LogP ≤ 5	1.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol?

The IUPAC name of (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol (CID 155439190) is (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol.

What is the SMILES notation for (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol?

The canonical SMILES for (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol is C[C@H](O)C1CC1C[C@H](O)C(F)(F)F.

What is the InChIKey of (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol?

The InChIKey is FVSONJQSNCFBCK-SZWNGJMLSA-N. The full InChI is InChI=1S/C8H13F3O2/c1-4(12)6-2-5(6)3-7(13)8(9,10)11/h4-7,12-13H,2-3H2,1H3/t4-,5?,6?,7-/m0/s1.

What are the key properties of (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol?

(2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol has a molecular weight of 198.18 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-1,1,1-trifluoro-3-[2-[(1S)-1-hydroxyethyl]cyclopropyl]propan-2-ol is sourced from PubChem (CID 155439190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 155439190 — identifiers, structure, computed properties (public domain)

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