(3R)-4-methoxy-3-propylhexan-1-ol

C10H22O2 — CID 89361343

IUPAC(3R)-4-methoxy-3-propylhexan-1-ol
SMILESCCC[C@H](CCO)C(CC)OC
InChIInChI=1S/C10H22O2/c1-4-6-9(7-8-11)10(5-2)12-3/h9-11H,4-8H2,1-3H3/t9-,10?/m1/s1
InChIKeyBGAYQQNHJVVMRE-YHMJZVADSA-N
MW174.28 g/mol
LogP2.21
Rot. Bonds7

About (3R)-4-methoxy-3-propylhexan-1-ol

(3R)-4-methoxy-3-propylhexan-1-ol (PubChem CID 89361343) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is (3R)-4-methoxy-3-propylhexan-1-ol.

Molecular Properties

Compound Name(3R)-4-methoxy-3-propylhexan-1-ol
PubChem CID89361343
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name(3R)-4-methoxy-3-propylhexan-1-ol
SMILESCCC[C@H](CCO)C(CC)OC
InChIInChI=1S/C10H22O2/c1-4-6-9(7-8-11)10(5-2)12-3/h9-11H,4-8H2,1-3H3/t9-,10?/m1/s1
InChIKeyBGAYQQNHJVVMRE-YHMJZVADSA-N
XLogP2.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-4-methoxy-3-propylhexan-1-ol?
The IUPAC name of (3R)-4-methoxy-3-propylhexan-1-ol (CID 89361343) is (3R)-4-methoxy-3-propylhexan-1-ol.
What is the SMILES notation for (3R)-4-methoxy-3-propylhexan-1-ol?
The canonical SMILES for (3R)-4-methoxy-3-propylhexan-1-ol is CCC[C@H](CCO)C(CC)OC.
What is the InChIKey of (3R)-4-methoxy-3-propylhexan-1-ol?
The InChIKey is BGAYQQNHJVVMRE-YHMJZVADSA-N. The full InChI is InChI=1S/C10H22O2/c1-4-6-9(7-8-11)10(5-2)12-3/h9-11H,4-8H2,1-3H3/t9-,10?/m1/s1.
What are the key properties of (3R)-4-methoxy-3-propylhexan-1-ol?
(3R)-4-methoxy-3-propylhexan-1-ol has a molecular weight of 174.28 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-4-methoxy-3-propylhexan-1-ol is sourced from PubChem (CID 89361343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).