(6R)-6-methylnonan-3-one

C10H20O — CID 11805013

IUPAC(6R)-6-methylnonan-3-one
SMILESCCC[C@@H](C)CCC(=O)CC
InChIInChI=1S/C10H20O/c1-4-6-9(3)7-8-10(11)5-2/h9H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyPULXPCACRCTXMF-SECBINFHSA-N
MW156.27 g/mol
LogP3.18
Rot. Bonds6

About (6R)-6-methylnonan-3-one

(6R)-6-methylnonan-3-one (PubChem CID 11805013) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is (6R)-6-methylnonan-3-one.

Molecular Properties

Compound Name(6R)-6-methylnonan-3-one
PubChem CID11805013
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name(6R)-6-methylnonan-3-one
SMILESCCC[C@@H](C)CCC(=O)CC
InChIInChI=1S/C10H20O/c1-4-6-9(3)7-8-10(11)5-2/h9H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyPULXPCACRCTXMF-SECBINFHSA-N
XLogP3.18
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-methylheptanoyl chloride
CID 14234515
(6S)-6-hydroxyheptan-3-one
CID 163026982
2-hydroxy-6-methylnonan-3-one
CID 123192108
4,8-dimethylundecanoic acid
CID 25230729
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
6-methylnon-1-en-3-one
CID 173408928
9-amino-7-methylnonan-4-one
CID 116581538
6,6-dichlorohexan-3-one
CID 15669105
4-methylheptane;propane
CID 142171269
6-hydroxyoctan-3-one
CID 15920952
2-aminoacetic acid;4-methylheptane
CID 143106228

Frequently Asked Questions

What is the IUPAC name of (6R)-6-methylnonan-3-one?
The IUPAC name of (6R)-6-methylnonan-3-one (CID 11805013) is (6R)-6-methylnonan-3-one.
What is the SMILES notation for (6R)-6-methylnonan-3-one?
The canonical SMILES for (6R)-6-methylnonan-3-one is CCC[C@@H](C)CCC(=O)CC.
What is the InChIKey of (6R)-6-methylnonan-3-one?
The InChIKey is PULXPCACRCTXMF-SECBINFHSA-N. The full InChI is InChI=1S/C10H20O/c1-4-6-9(3)7-8-10(11)5-2/h9H,4-8H2,1-3H3/t9-/m1/s1.
What are the key properties of (6R)-6-methylnonan-3-one?
(6R)-6-methylnonan-3-one has a molecular weight of 156.27 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-methylnonan-3-one is sourced from PubChem (CID 11805013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).