2-iodo-2-methylnonane

C10H21I — CID 12714355

IUPAC2-iodo-2-methylnonane
SMILESCCCCCCCC(C)(C)I
InChIInChI=1S/C10H21I/c1-4-5-6-7-8-9-10(2,3)11/h4-9H2,1-3H3
InChIKeyUMVVOJAPRKDYBC-UHFFFAOYSA-N
MW268.18 g/mol
LogP4.56
Rot. Bonds6

About 2-iodo-2-methylnonane

2-iodo-2-methylnonane (PubChem CID 12714355) has the molecular formula C10H21I and a molecular weight of 268.18 g/mol. Its IUPAC name is 2-iodo-2-methylnonane.

Molecular Properties

Compound Name2-iodo-2-methylnonane
PubChem CID12714355
Molecular FormulaC10H21I
Molecular Weight268.18 g/mol
Exact Mass268.07
IUPAC Name2-iodo-2-methylnonane
SMILESCCCCCCCC(C)(C)I
InChIInChI=1S/C10H21I/c1-4-5-6-7-8-9-10(2,3)11/h4-9H2,1-3H3
InChIKeyUMVVOJAPRKDYBC-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.18
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

10,10-diiodononadecane
CID 154405241
silane;1,1,1-triiodooctadecane
CID 173345600
11-methyl-11-nonylhenicosane
CID 19690388
13-methyl-13-octylhentriacontane
CID 173152457
16,16,21,21-tetramethylhexatriacontane
CID 174880889
1,1-diiododecan-1-ol
CID 118276104
2,2-dimethylpropane;heptane
CID 144531055
5-butyl-5-methylpentadecane
CID 174700907
azane;2,2-dimethylundecane
CID 172735807
2,2-dimethylundecane;hydrobromide
CID 172814192
5,5,6,6-tetramethyltridecane
CID 173349107
1,2-diiodo-2-methylheptane
CID 54368086

Frequently Asked Questions

What is the IUPAC name of 2-iodo-2-methylnonane?
The IUPAC name of 2-iodo-2-methylnonane (CID 12714355) is 2-iodo-2-methylnonane.
What is the SMILES notation for 2-iodo-2-methylnonane?
The canonical SMILES for 2-iodo-2-methylnonane is CCCCCCCC(C)(C)I.
What is the InChIKey of 2-iodo-2-methylnonane?
The InChIKey is UMVVOJAPRKDYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21I/c1-4-5-6-7-8-9-10(2,3)11/h4-9H2,1-3H3.
What are the key properties of 2-iodo-2-methylnonane?
2-iodo-2-methylnonane has a molecular weight of 268.18 g/mol, XLogP of 4.56, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-2-methylnonane is sourced from PubChem (CID 12714355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).