(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol

C10H18O — CID 102533409

IUPAC(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol
SMILESC=C=C(CC)[C@H](O)CC(C)C
InChIInChI=1S/C10H18O/c1-5-9(6-2)10(11)7-8(3)4/h8,10-11H,1,6-7H2,2-4H3/t10-/m1/s1
InChIKeyKUFHOQVVTVTXJA-SNVBAGLBSA-N
MW154.25 g/mol
LogP2.51
Rot. Bonds4

About (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol

(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol (PubChem CID 102533409) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol.

Molecular Properties

Compound Name(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol
PubChem CID102533409
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol
SMILESC=C=C(CC)[C@H](O)CC(C)C
InChIInChI=1S/C10H18O/c1-5-9(6-2)10(11)7-8(3)4/h8,10-11H,1,6-7H2,2-4H3/t10-/m1/s1
InChIKeyKUFHOQVVTVTXJA-SNVBAGLBSA-N
XLogP2.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol?
The IUPAC name of (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol (CID 102533409) is (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol.
What is the SMILES notation for (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol?
The canonical SMILES for (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol is C=C=C(CC)[C@H](O)CC(C)C.
What is the InChIKey of (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol?
The InChIKey is KUFHOQVVTVTXJA-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H18O/c1-5-9(6-2)10(11)7-8(3)4/h8,10-11H,1,6-7H2,2-4H3/t10-/m1/s1.
What are the key properties of (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol?
(4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol has a molecular weight of 154.25 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-ethyl-6-methylhepta-1,2-dien-4-ol is sourced from PubChem (CID 102533409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).