dec-9-en-1-olate

C10H19O- — CID 59297553

IUPACdec-9-en-1-olate
SMILESC=CCCCCCCCC[O-]
InChIInChI=1S/C10H19O/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/q-1
InChIKeyKNQIBOAUMNFSPT-UHFFFAOYSA-N
MW155.26 g/mol
LogP2.26
Rot. Bonds8

About dec-9-en-1-olate

dec-9-en-1-olate (PubChem CID 59297553) has the molecular formula C10H19O- and a molecular weight of 155.26 g/mol. Its IUPAC name is dec-9-en-1-olate.

Molecular Properties

Compound Namedec-9-en-1-olate
PubChem CID59297553
Molecular FormulaC10H19O-
Molecular Weight155.26 g/mol
Exact Mass155.14
IUPAC Namedec-9-en-1-olate
SMILESC=CCCCCCCCC[O-]
InChIInChI=1S/C10H19O/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/q-1
InChIKeyKNQIBOAUMNFSPT-UHFFFAOYSA-N
XLogP2.26
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.26
LogP ≤ 52.26
H-Bond Donors ≤ 50
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

9-Decen-1-ol
CID 25612
10-Undecen-1-ol
CID 8185
(7-Octenyl)oxirane
CID 543758
Oct-7-en-1-ol
CID 83203
Tetradecenol
CID 120110
1-Decene, 10-methoxy-
CID 3085890
Non-8-en-1-ol
CID 11094728
11-Dodecen-1-ol
CID 520725
(R)-(+)-1,2-Epoxy-9-decene
CID 7018005
2-Dodec-11-enyloxirane
CID 5743593
O-(undec-10-en-1-yl)hydroxylamine
CID 59030215
Tridec-12-en-1-ol
CID 15486836

Frequently Asked Questions

What is the IUPAC name of dec-9-en-1-olate?
The IUPAC name of dec-9-en-1-olate (CID 59297553) is dec-9-en-1-olate.
What is the SMILES notation for dec-9-en-1-olate?
The canonical SMILES for dec-9-en-1-olate is C=CCCCCCCCC[O-].
What is the InChIKey of dec-9-en-1-olate?
The InChIKey is KNQIBOAUMNFSPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19O/c1-2-3-4-5-6-7-8-9-10-11/h2H,1,3-10H2/q-1.
What are the key properties of dec-9-en-1-olate?
dec-9-en-1-olate has a molecular weight of 155.26 g/mol, XLogP of 2.26, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dec-9-en-1-olate is sourced from PubChem (CID 59297553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).