(4R,7R)-deca-1,9-diene-4,7-diol

C10H18O2 — CID 57215410

IUPAC(4R,7R)-deca-1,9-diene-4,7-diol
SMILESC=CC[C@H](O)CC[C@@H](O)CC=C
InChIInChI=1S/C10H18O2/c1-3-5-9(11)7-8-10(12)6-4-2/h3-4,9-12H,1-2,5-8H2/t9-,10-/m0/s1
InChIKeyGVCRSFJGFBHCIK-UWVGGRQHSA-N
MW170.25 g/mol
LogP1.64
Rot. Bonds7

About (4R,7R)-deca-1,9-diene-4,7-diol

(4R,7R)-deca-1,9-diene-4,7-diol (PubChem CID 57215410) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is (4R,7R)-deca-1,9-diene-4,7-diol.

Molecular Properties

Compound Name(4R,7R)-deca-1,9-diene-4,7-diol
PubChem CID57215410
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name(4R,7R)-deca-1,9-diene-4,7-diol
SMILESC=CC[C@H](O)CC[C@@H](O)CC=C
InChIInChI=1S/C10H18O2/c1-3-5-9(11)7-8-10(12)6-4-2/h3-4,9-12H,1-2,5-8H2/t9-,10-/m0/s1
InChIKeyGVCRSFJGFBHCIK-UWVGGRQHSA-N
XLogP1.64
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4R,7R)-deca-1,9-diene-4,7-diol?
The IUPAC name of (4R,7R)-deca-1,9-diene-4,7-diol (CID 57215410) is (4R,7R)-deca-1,9-diene-4,7-diol.
What is the SMILES notation for (4R,7R)-deca-1,9-diene-4,7-diol?
The canonical SMILES for (4R,7R)-deca-1,9-diene-4,7-diol is C=CC[C@H](O)CC[C@@H](O)CC=C.
What is the InChIKey of (4R,7R)-deca-1,9-diene-4,7-diol?
The InChIKey is GVCRSFJGFBHCIK-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-5-9(11)7-8-10(12)6-4-2/h3-4,9-12H,1-2,5-8H2/t9-,10-/m0/s1.
What are the key properties of (4R,7R)-deca-1,9-diene-4,7-diol?
(4R,7R)-deca-1,9-diene-4,7-diol has a molecular weight of 170.25 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,7R)-deca-1,9-diene-4,7-diol is sourced from PubChem (CID 57215410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).