(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol

C10H17IO3 — CID 10086830

IUPAC(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol
SMILESOC/C=C(\I)CCOC1CCCCO1
InChIInChI=1S/C10H17IO3/c11-9(4-6-12)5-8-14-10-3-1-2-7-13-10/h4,10,12H,1-3,5-8H2/b9-4-
InChIKeyNDNYKBFMUGBJNJ-WTKPLQERSA-N
MW312.15 g/mol
LogP2.23
Rot. Bonds5

About (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol

(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol (PubChem CID 10086830) has the molecular formula C10H17IO3 and a molecular weight of 312.15 g/mol. Its IUPAC name is (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol
PubChem CID10086830
Molecular FormulaC10H17IO3
Molecular Weight312.15 g/mol
Exact Mass312.02
IUPAC Name(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol
SMILESOC/C=C(\I)CCOC1CCCCO1
InChIInChI=1S/C10H17IO3/c11-9(4-6-12)5-8-14-10-3-1-2-7-13-10/h4,10,12H,1-3,5-8H2/b9-4-
InChIKeyNDNYKBFMUGBJNJ-WTKPLQERSA-N
XLogP2.23
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.15
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(6-Hydroxy-trans-4-hexenyloxy)tetrahydropyran
CID 13411670
(Z)-2-methyl-5-(oxan-2-yloxy)pent-2-en-1-ol
CID 10987270
(2E,5E)-7-(oxan-2-yloxy)hepta-2,5-dien-1-ol
CID 10656179
(E)-5-(oxan-2-yloxy)pent-2-en-1-ol
CID 10888667
(Z)-5-(oxan-2-yloxy)pent-3-en-1-ol
CID 11805454
(Z)-7-(oxan-2-yloxy)hept-2-en-1-ol
CID 13853643
(E)-7-(oxan-2-yloxy)hept-2-en-1-ol
CID 13853644
(Z)-5-(oxan-2-yloxy)pent-2-en-1-ol
CID 13940452
2-[(Z)-6-iodohex-3-enoxy]oxane
CID 14359696
(2E,4E)-7-(oxan-2-yloxy)hepta-2,4-dien-1-ol
CID 14888425
2-Methyl-5-(oxan-2-yloxy)pent-2-en-1-ol
CID 53947841
6-(Oxan-2-yloxy)hex-2-en-1-ol
CID 53948908

Frequently Asked Questions

What is the IUPAC name of (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol?
The IUPAC name of (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol (CID 10086830) is (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol.
What is the SMILES notation for (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol?
The canonical SMILES for (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol is OC/C=C(\I)CCOC1CCCCO1.
What is the InChIKey of (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol?
The InChIKey is NDNYKBFMUGBJNJ-WTKPLQERSA-N. The full InChI is InChI=1S/C10H17IO3/c11-9(4-6-12)5-8-14-10-3-1-2-7-13-10/h4,10,12H,1-3,5-8H2/b9-4-.
What are the key properties of (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol?
(Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol has a molecular weight of 312.15 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-iodo-5-(oxan-2-yloxy)pent-2-en-1-ol is sourced from PubChem (CID 10086830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).