2,10-dihydroxyundecan-6-one

C11H22O3 — CID 56979503

IUPAC2,10-dihydroxyundecan-6-one
SMILESCC(O)CCCC(=O)CCCC(C)O
InChIInChI=1S/C11H22O3/c1-9(12)5-3-7-11(14)8-4-6-10(2)13/h9-10,12-13H,3-8H2,1-2H3
InChIKeyUHLRCHMFJOLUIR-UHFFFAOYSA-N
MW202.29 g/mol
LogP1.66
Rot. Bonds8

About 2,10-dihydroxyundecan-6-one

2,10-dihydroxyundecan-6-one (PubChem CID 56979503) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 2,10-dihydroxyundecan-6-one.

Molecular Properties

Compound Name2,10-dihydroxyundecan-6-one
PubChem CID56979503
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name2,10-dihydroxyundecan-6-one
SMILESCC(O)CCCC(=O)CCCC(C)O
InChIInChI=1S/C11H22O3/c1-9(12)5-3-7-11(14)8-4-6-10(2)13/h9-10,12-13H,3-8H2,1-2H3
InChIKeyUHLRCHMFJOLUIR-UHFFFAOYSA-N
XLogP1.66
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-hydroxy-2-methylnonan-4-one
CID 57006312
2,8-dihydroxynonan-5-one
CID 174799972
(5R)-5-hydroxyhexanoate
CID 7131042
2,10-diiodoundecan-6-one
CID 87448704
11-hydroxy-3-oxododecanoic acid
CID 644255
2,16-dimethylheptadecan-6-one
CID 158111781
5-hydroxy-N-[4-(5-hydroxyhexanoylamino)butyl]hexanamide
CID 101050420
20-hydroxyhenicosanoic acid
CID 19591814
19-hydroxyicosanoic acid
CID 14535566
1-hydroxy-8-methylnonan-4-one
CID 87402189
(E)-1-(3,5-dihydroxyphenyl)-10-hydroxyundec-1-en-6-one
CID 122659985
dichloromethyl 5-hydroxyhexanoate
CID 57271090

Frequently Asked Questions

What is the IUPAC name of 2,10-dihydroxyundecan-6-one?
The IUPAC name of 2,10-dihydroxyundecan-6-one (CID 56979503) is 2,10-dihydroxyundecan-6-one.
What is the SMILES notation for 2,10-dihydroxyundecan-6-one?
The canonical SMILES for 2,10-dihydroxyundecan-6-one is CC(O)CCCC(=O)CCCC(C)O.
What is the InChIKey of 2,10-dihydroxyundecan-6-one?
The InChIKey is UHLRCHMFJOLUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-9(12)5-3-7-11(14)8-4-6-10(2)13/h9-10,12-13H,3-8H2,1-2H3.
What are the key properties of 2,10-dihydroxyundecan-6-one?
2,10-dihydroxyundecan-6-one has a molecular weight of 202.29 g/mol, XLogP of 1.66, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,10-dihydroxyundecan-6-one is sourced from PubChem (CID 56979503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).