(5R)-9-iodo-5-methylnonan-1-ol

C10H21IO — CID 139766803

IUPAC(5R)-9-iodo-5-methylnonan-1-ol
SMILESC[C@H](CCCCO)CCCCI
InChIInChI=1S/C10H21IO/c1-10(6-2-4-8-11)7-3-5-9-12/h10,12H,2-9H2,1H3/t10-/m0/s1
InChIKeySTCCPOQIJOVDNZ-JTQLQIEISA-N
MW284.18 g/mol
LogP3.39
Rot. Bonds8

About (5R)-9-iodo-5-methylnonan-1-ol

(5R)-9-iodo-5-methylnonan-1-ol (PubChem CID 139766803) has the molecular formula C10H21IO and a molecular weight of 284.18 g/mol. Its IUPAC name is (5R)-9-iodo-5-methylnonan-1-ol.

Molecular Properties

Compound Name(5R)-9-iodo-5-methylnonan-1-ol
PubChem CID139766803
Molecular FormulaC10H21IO
Molecular Weight284.18 g/mol
Exact Mass284.06
IUPAC Name(5R)-9-iodo-5-methylnonan-1-ol
SMILESC[C@H](CCCCO)CCCCI
InChIInChI=1S/C10H21IO/c1-10(6-2-4-8-11)7-3-5-9-12/h10,12H,2-9H2,1H3/t10-/m0/s1
InChIKeySTCCPOQIJOVDNZ-JTQLQIEISA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-iodo-4-methylhexan-1-ol
CID 139625699
8,12-dimethylicosane-1,20-diol
CID 170848864
3-methyldecane-1,10-diol
CID 22596513
(5S)-5-methyloctan-1-ol
CID 14902476
10-methylhexadecan-1-ol
CID 10244159
6-methylhexadecan-1-ol
CID 22027437
(5S)-7-chloro-5-methylheptan-1-ol
CID 139766924
7-methylpentadecan-1-ol
CID 18427312
2,6,10,15,19,23-hexamethyltetracosane;16-methylheptadecan-1-ol
CID 174818152
9-methylhexadecan-1-ol
CID 22027455
(6S)-6-methyloctadecan-1-ol
CID 162994676
9-amino-5-methylnonan-1-ol
CID 57209196

Frequently Asked Questions

What is the IUPAC name of (5R)-9-iodo-5-methylnonan-1-ol?
The IUPAC name of (5R)-9-iodo-5-methylnonan-1-ol (CID 139766803) is (5R)-9-iodo-5-methylnonan-1-ol.
What is the SMILES notation for (5R)-9-iodo-5-methylnonan-1-ol?
The canonical SMILES for (5R)-9-iodo-5-methylnonan-1-ol is C[C@H](CCCCO)CCCCI.
What is the InChIKey of (5R)-9-iodo-5-methylnonan-1-ol?
The InChIKey is STCCPOQIJOVDNZ-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21IO/c1-10(6-2-4-8-11)7-3-5-9-12/h10,12H,2-9H2,1H3/t10-/m0/s1.
What are the key properties of (5R)-9-iodo-5-methylnonan-1-ol?
(5R)-9-iodo-5-methylnonan-1-ol has a molecular weight of 284.18 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-9-iodo-5-methylnonan-1-ol is sourced from PubChem (CID 139766803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).