(1S)-1-(oxolan-2-yl)propan-1-ol

C7H14O2 — CID 67355523

IUPAC(1S)-1-(oxolan-2-yl)propan-1-ol
SMILESCC[C@H](O)C1CCCO1
InChIInChI=1S/C7H14O2/c1-2-6(8)7-4-3-5-9-7/h6-8H,2-5H2,1H3/t6-,7?/m0/s1
InChIKeyYURZFYINXLRBDR-PKPIPKONSA-N
MW130.19 g/mol
LogP0.94
Rot. Bonds2

About (1S)-1-(oxolan-2-yl)propan-1-ol

(1S)-1-(oxolan-2-yl)propan-1-ol (PubChem CID 67355523) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is (1S)-1-(oxolan-2-yl)propan-1-ol.

Molecular Properties

Compound Name(1S)-1-(oxolan-2-yl)propan-1-ol
PubChem CID67355523
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name(1S)-1-(oxolan-2-yl)propan-1-ol
SMILESCC[C@H](O)C1CCCO1
InChIInChI=1S/C7H14O2/c1-2-6(8)7-4-3-5-9-7/h6-8H,2-5H2,1H3/t6-,7?/m0/s1
InChIKeyYURZFYINXLRBDR-PKPIPKONSA-N
XLogP0.94
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-(oxolan-2-yl)propan-1-ol?
The IUPAC name of (1S)-1-(oxolan-2-yl)propan-1-ol (CID 67355523) is (1S)-1-(oxolan-2-yl)propan-1-ol.
What is the SMILES notation for (1S)-1-(oxolan-2-yl)propan-1-ol?
The canonical SMILES for (1S)-1-(oxolan-2-yl)propan-1-ol is CC[C@H](O)C1CCCO1.
What is the InChIKey of (1S)-1-(oxolan-2-yl)propan-1-ol?
The InChIKey is YURZFYINXLRBDR-PKPIPKONSA-N. The full InChI is InChI=1S/C7H14O2/c1-2-6(8)7-4-3-5-9-7/h6-8H,2-5H2,1H3/t6-,7?/m0/s1.
What are the key properties of (1S)-1-(oxolan-2-yl)propan-1-ol?
(1S)-1-(oxolan-2-yl)propan-1-ol has a molecular weight of 130.19 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(oxolan-2-yl)propan-1-ol is sourced from PubChem (CID 67355523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).