(E)-2-propyldec-7-en-1-ol

C13H26O — CID 23074704

IUPAC(E)-2-propyldec-7-en-1-ol
SMILESCC/C=C/CCCCC(CO)CCC
InChIInChI=1S/C13H26O/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h5-6,13-14H,3-4,7-12H2,1-2H3/b6-5+
InChIKeyFLLRFUHPRRONTQ-AATRIKPKSA-N
MW198.35 g/mol
LogP3.92
Rot. Bonds9

About (E)-2-propyldec-7-en-1-ol

(E)-2-propyldec-7-en-1-ol (PubChem CID 23074704) has the molecular formula C13H26O and a molecular weight of 198.35 g/mol. Its IUPAC name is (E)-2-propyldec-7-en-1-ol.

Molecular Properties

Compound Name(E)-2-propyldec-7-en-1-ol
PubChem CID23074704
Molecular FormulaC13H26O
Molecular Weight198.35 g/mol
Exact Mass198.20
IUPAC Name(E)-2-propyldec-7-en-1-ol
SMILESCC/C=C/CCCCC(CO)CCC
InChIInChI=1S/C13H26O/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h5-6,13-14H,3-4,7-12H2,1-2H3/b6-5+
InChIKeyFLLRFUHPRRONTQ-AATRIKPKSA-N
XLogP3.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-(aminomethyl)undec-7-en-1-ol
CID 145001245
(2S)-2-propyldecan-1-ol
CID 10176571
2-propylheptadecan-1-ol
CID 137441509
2-propyldodecan-1-ol
CID 14438908
(Z)-non-6-ene-1,1-diol
CID 170555028
11-ethyltetradec-4-ene
CID 123216279
13-propylhenicos-9-ene
CID 175294626
(E,2R)-dec-7-en-2-ol
CID 89151124
2-ethyloct-5-en-1-ol
CID 54387692
3-octadec-9-enylpentane-1,5-diol
CID 91381537
6-propylhexadec-8-ene
CID 174779500
19-propyltritriaconta-6,9,24-triene
CID 54372361

Frequently Asked Questions

What is the IUPAC name of (E)-2-propyldec-7-en-1-ol?
The IUPAC name of (E)-2-propyldec-7-en-1-ol (CID 23074704) is (E)-2-propyldec-7-en-1-ol.
What is the SMILES notation for (E)-2-propyldec-7-en-1-ol?
The canonical SMILES for (E)-2-propyldec-7-en-1-ol is CC/C=C/CCCCC(CO)CCC.
What is the InChIKey of (E)-2-propyldec-7-en-1-ol?
The InChIKey is FLLRFUHPRRONTQ-AATRIKPKSA-N. The full InChI is InChI=1S/C13H26O/c1-3-5-6-7-8-9-11-13(12-14)10-4-2/h5-6,13-14H,3-4,7-12H2,1-2H3/b6-5+.
What are the key properties of (E)-2-propyldec-7-en-1-ol?
(E)-2-propyldec-7-en-1-ol has a molecular weight of 198.35 g/mol, XLogP of 3.92, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-propyldec-7-en-1-ol is sourced from PubChem (CID 23074704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).