1,10-bis(prop-1-enoxy)decane

C16H30O2 — CID 54271291

IUPAC1,10-bis(prop-1-enoxy)decane
SMILESCC=COCCCCCCCCCCOC=CC
InChIInChI=1S/C16H30O2/c1-3-13-17-15-11-9-7-5-6-8-10-12-16-18-14-4-2/h3-4,13-14H,5-12,15-16H2,1-2H3
InChIKeyRKHXKNKPYLRWER-UHFFFAOYSA-N
MW254.41 g/mol
LogP5.21
Rot. Bonds13

About 1,10-bis(prop-1-enoxy)decane

1,10-bis(prop-1-enoxy)decane (PubChem CID 54271291) has the molecular formula C16H30O2 and a molecular weight of 254.41 g/mol. Its IUPAC name is 1,10-bis(prop-1-enoxy)decane.

Molecular Properties

Compound Name1,10-bis(prop-1-enoxy)decane
PubChem CID54271291
Molecular FormulaC16H30O2
Molecular Weight254.41 g/mol
Exact Mass254.22
IUPAC Name1,10-bis(prop-1-enoxy)decane
SMILESCC=COCCCCCCCCCCOC=CC
InChIInChI=1S/C16H30O2/c1-3-13-17-15-11-9-7-5-6-8-10-12-16-18-14-4-2/h3-4,13-14H,5-12,15-16H2,1-2H3
InChIKeyRKHXKNKPYLRWER-UHFFFAOYSA-N
XLogP5.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.41
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(Z)-prop-1-enoxy]-4-[(E)-prop-1-enoxy]butane
CID 131862355
1-prop-1-enoxydecane
CID 54116737
8-methyl-1-prop-1-enoxynonane
CID 152729157
trimethoxy(7-prop-1-enoxyheptyl)silane
CID 151084650
phosphoric acid;1-prop-1-enoxydodecane
CID 175408861
1-isocyanato-8-prop-1-enoxyoctane
CID 151373241
1-hex-2-enoxy-7-prop-1-enoxyheptane
CID 173319235
silane;tribromo(3-prop-1-enoxypropyl)silane
CID 161219815
[1,7-bis(prop-1-enoxy)-4-(3-prop-1-enoxypropyl)heptan-4-yl]oxysilane
CID 123385784
2-[3-[(E)-prop-1-enoxy]propyl]thiirane
CID 176604691
4,4-diethoxy-1-prop-1-enoxypentane
CID 151988040
1-octa-1,6-dienoxyoctane
CID 88510416

Frequently Asked Questions

What is the IUPAC name of 1,10-bis(prop-1-enoxy)decane?
The IUPAC name of 1,10-bis(prop-1-enoxy)decane (CID 54271291) is 1,10-bis(prop-1-enoxy)decane.
What is the SMILES notation for 1,10-bis(prop-1-enoxy)decane?
The canonical SMILES for 1,10-bis(prop-1-enoxy)decane is CC=COCCCCCCCCCCOC=CC.
What is the InChIKey of 1,10-bis(prop-1-enoxy)decane?
The InChIKey is RKHXKNKPYLRWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O2/c1-3-13-17-15-11-9-7-5-6-8-10-12-16-18-14-4-2/h3-4,13-14H,5-12,15-16H2,1-2H3.
What are the key properties of 1,10-bis(prop-1-enoxy)decane?
1,10-bis(prop-1-enoxy)decane has a molecular weight of 254.41 g/mol, XLogP of 5.21, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,10-bis(prop-1-enoxy)decane is sourced from PubChem (CID 54271291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).