(4R)-4-propoxypentan-1-ol

C8H18O2 — CID 54320299

IUPAC(4R)-4-propoxypentan-1-ol
SMILESCCCO[C@H](C)CCCO
InChIInChI=1S/C8H18O2/c1-3-7-10-8(2)5-4-6-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChIKeySREHHRYTRGUEPA-MRVPVSSYSA-N
MW146.23 g/mol
LogP1.57
Rot. Bonds6

About (4R)-4-propoxypentan-1-ol

(4R)-4-propoxypentan-1-ol (PubChem CID 54320299) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is (4R)-4-propoxypentan-1-ol.

Molecular Properties

Compound Name(4R)-4-propoxypentan-1-ol
PubChem CID54320299
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Name(4R)-4-propoxypentan-1-ol
SMILESCCCO[C@H](C)CCCO
InChIInChI=1S/C8H18O2/c1-3-7-10-8(2)5-4-6-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChIKeySREHHRYTRGUEPA-MRVPVSSYSA-N
XLogP1.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2S)-pentan-2-yl]oxyethanol
CID 89167429
2-(1-octan-2-yloxypropan-2-yloxy)ethanol
CID 20688305
2-decan-2-yloxyethanol;sulfuric acid
CID 158151690
2,5,6-trimethyl-9-propoxydecane
CID 143799470
2-(2-dodecan-2-yloxyethoxy)ethanol
CID 71420952
2-[2-(2-decan-2-yloxyethoxy)ethoxy]ethanol
CID 87813837
5-propoxyhexanal
CID 57004791
5-(5-methoxyhexoxy)hexan-1-ol
CID 165144322
2-butoxyhexane;ethane
CID 144590910
3-[(2R)-butan-2-yl]oxypropan-1-ol
CID 5315839
2-(1-propoxypropan-2-yloxy)ethanol
CID 59676189
8-methoxy-8-propoxyoctane-1,4,5,7-tetrol
CID 170743133

Frequently Asked Questions

What is the IUPAC name of (4R)-4-propoxypentan-1-ol?
The IUPAC name of (4R)-4-propoxypentan-1-ol (CID 54320299) is (4R)-4-propoxypentan-1-ol.
What is the SMILES notation for (4R)-4-propoxypentan-1-ol?
The canonical SMILES for (4R)-4-propoxypentan-1-ol is CCCO[C@H](C)CCCO.
What is the InChIKey of (4R)-4-propoxypentan-1-ol?
The InChIKey is SREHHRYTRGUEPA-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H18O2/c1-3-7-10-8(2)5-4-6-9/h8-9H,3-7H2,1-2H3/t8-/m1/s1.
What are the key properties of (4R)-4-propoxypentan-1-ol?
(4R)-4-propoxypentan-1-ol has a molecular weight of 146.23 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-propoxypentan-1-ol is sourced from PubChem (CID 54320299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).