(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol

C18H26O — CID 14452107

IUPAC(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol
SMILESCCCCCC/C=C(/C=C/c1ccccc1)CCO
InChIInChI=1S/C18H26O/c1-2-3-4-5-7-12-18(15-16-19)14-13-17-10-8-6-9-11-17/h6,8-14,19H,2-5,7,15-16H2,1H3/b14-13+,18-12-
InChIKeyVRJXOFHDPDQCRJ-NDXUSBDCSA-N
MW258.40 g/mol
LogP4.98
Rot. Bonds9

About (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol

(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol (PubChem CID 14452107) has the molecular formula C18H26O and a molecular weight of 258.40 g/mol. Its IUPAC name is (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol.

Molecular Properties

Compound Name(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol
PubChem CID14452107
Molecular FormulaC18H26O
Molecular Weight258.40 g/mol
Exact Mass258.20
IUPAC Name(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol
SMILESCCCCCC/C=C(/C=C/c1ccccc1)CCO
InChIInChI=1S/C18H26O/c1-2-3-4-5-7-12-18(15-16-19)14-13-17-10-8-6-9-11-17/h6,8-14,19H,2-5,7,15-16H2,1H3/b14-13+,18-12-
InChIKeyVRJXOFHDPDQCRJ-NDXUSBDCSA-N
XLogP4.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.40
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 135039609
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CID 11437654
pentan-1-ol;(E)-stilbene
CID 172553874
[(E)-octadec-1-enyl]benzene
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(Z)-1-phenyltetradec-1-en-3-one
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1-phenylundec-1-en-3-one
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octadeca-1,3-dienylbenzene
CID 54155436
[(1E,3E)-undeca-1,3-dienyl]benzene
CID 10633133
oct-1-enylbenzene;phosphoric acid
CID 159316508
[(Z)-tetradec-1-enyl] 3-phenylprop-2-enoate
CID 58975815
4-benzylidene-1-phenylheptadec-1-en-3-one
CID 54442724
trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane
CID 134982365

Frequently Asked Questions

What is the IUPAC name of (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol?
The IUPAC name of (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol (CID 14452107) is (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol.
What is the SMILES notation for (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol?
The canonical SMILES for (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol is CCCCCC/C=C(/C=C/c1ccccc1)CCO.
What is the InChIKey of (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol?
The InChIKey is VRJXOFHDPDQCRJ-NDXUSBDCSA-N. The full InChI is InChI=1S/C18H26O/c1-2-3-4-5-7-12-18(15-16-19)14-13-17-10-8-6-9-11-17/h6,8-14,19H,2-5,7,15-16H2,1H3/b14-13+,18-12-.
What are the key properties of (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol?
(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol has a molecular weight of 258.40 g/mol, XLogP of 4.98, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol is sourced from PubChem (CID 14452107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).