(E)-dodec-5-en-2-ol

C12H24O — CID 10511710

IUPAC(E)-dodec-5-en-2-ol
SMILESCCCCCC/C=C/CCC(C)O
InChIInChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h8-9,12-13H,3-7,10-11H2,1-2H3/b9-8+
InChIKeyMCRCRUDECZPBRK-CMDGGOBGSA-N
MW184.32 g/mol
LogP3.67
Rot. Bonds8

About (E)-dodec-5-en-2-ol

(E)-dodec-5-en-2-ol (PubChem CID 10511710) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is (E)-dodec-5-en-2-ol.

Molecular Properties

Compound Name(E)-dodec-5-en-2-ol
PubChem CID10511710
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name(E)-dodec-5-en-2-ol
SMILESCCCCCC/C=C/CCC(C)O
InChIInChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h8-9,12-13H,3-7,10-11H2,1-2H3/b9-8+
InChIKeyMCRCRUDECZPBRK-CMDGGOBGSA-N
XLogP3.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.67
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

tetracos-5-en-2-ol
CID 173208999
(Z)-henicos-12-en-2-ol
CID 141141779
heptadec-9-en-2-ol
CID 54154410
icos-9-en-2-ol
CID 91416664
(Z)-tridec-7-en-2-ol
CID 89138962
(E)-tridec-8-en-2-ol
CID 173250287
nonadeca-7,10,13-trien-2-ol
CID 54048695
(Z)-tetracos-6-en-10-ol
CID 168947717
(E)-hentriacont-22-ene-2,4-diol
CID 101083869
octacos-21-en-10-ol
CID 163011476
(Z)-octacos-19-ene-10,11-diol
CID 87651448
(E)-nonadec-5-ene-1,2-diol
CID 142781627

Frequently Asked Questions

What is the IUPAC name of (E)-dodec-5-en-2-ol?
The IUPAC name of (E)-dodec-5-en-2-ol (CID 10511710) is (E)-dodec-5-en-2-ol.
What is the SMILES notation for (E)-dodec-5-en-2-ol?
The canonical SMILES for (E)-dodec-5-en-2-ol is CCCCCC/C=C/CCC(C)O.
What is the InChIKey of (E)-dodec-5-en-2-ol?
The InChIKey is MCRCRUDECZPBRK-CMDGGOBGSA-N. The full InChI is InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h8-9,12-13H,3-7,10-11H2,1-2H3/b9-8+.
What are the key properties of (E)-dodec-5-en-2-ol?
(E)-dodec-5-en-2-ol has a molecular weight of 184.32 g/mol, XLogP of 3.67, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dodec-5-en-2-ol is sourced from PubChem (CID 10511710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).