(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene

C14H26O — CID 87913402

IUPAC(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene
SMILESC/C=C(/CC(C)C)O/C(=C\C)CC(C)C
InChIInChI=1S/C14H26O/c1-7-13(9-11(3)4)15-14(8-2)10-12(5)6/h7-8,11-12H,9-10H2,1-6H3/b13-7-,14-8-
InChIKeyBFLMYWNPAQFGSN-PVRNWPCDSA-N
MW210.36 g/mol
LogP4.90
Rot. Bonds6

About (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene

(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene (PubChem CID 87913402) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene.

Molecular Properties

Compound Name(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene
PubChem CID87913402
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene
SMILESC/C=C(/CC(C)C)O/C(=C\C)CC(C)C
InChIInChI=1S/C14H26O/c1-7-13(9-11(3)4)15-14(8-2)10-12(5)6/h7-8,11-12H,9-10H2,1-6H3/b13-7-,14-8-
InChIKeyBFLMYWNPAQFGSN-PVRNWPCDSA-N
XLogP4.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene?
The IUPAC name of (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene (CID 87913402) is (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene.
What is the SMILES notation for (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene?
The canonical SMILES for (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene is C/C=C(/CC(C)C)O/C(=C\C)CC(C)C.
What is the InChIKey of (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene?
The InChIKey is BFLMYWNPAQFGSN-PVRNWPCDSA-N. The full InChI is InChI=1S/C14H26O/c1-7-13(9-11(3)4)15-14(8-2)10-12(5)6/h7-8,11-12H,9-10H2,1-6H3/b13-7-,14-8-.
What are the key properties of (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene?
(Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene has a molecular weight of 210.36 g/mol, XLogP of 4.90, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-methyl-3-[(Z)-5-methylhex-2-en-3-yl]oxyhex-2-ene is sourced from PubChem (CID 87913402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).