(7R)-7-methyltricosane

C24H50 — CID 162971691

IUPAC(7R)-7-methyltricosane
SMILESCCCCCCCCCCCCCCCC[C@H](C)CCCCCC
InChIInChI=1S/C24H50/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-23-24(3)22-20-9-7-5-2/h24H,4-23H2,1-3H3/t24-/m1/s1
InChIKeyULRDOMATUJWTEF-XMMPIXPASA-N
MW338.66 g/mol
LogP9.46
Rot. Bonds20

About (7R)-7-methyltricosane

(7R)-7-methyltricosane (PubChem CID 162971691) has the molecular formula C24H50 and a molecular weight of 338.66 g/mol. Its IUPAC name is (7R)-7-methyltricosane.

Molecular Properties

Compound Name(7R)-7-methyltricosane
PubChem CID162971691
Molecular FormulaC24H50
Molecular Weight338.66 g/mol
Exact Mass338.39
IUPAC Name(7R)-7-methyltricosane
SMILESCCCCCCCCCCCCCCCC[C@H](C)CCCCCC
InChIInChI=1S/C24H50/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-23-24(3)22-20-9-7-5-2/h24H,4-23H2,1-3H3/t24-/m1/s1
InChIKeyULRDOMATUJWTEF-XMMPIXPASA-N
XLogP9.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds20
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.66
LogP ≤ 59.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

6-methyloctacosane
CID 22223942
27-methyltripentacontane
CID 91450521
8,13-dimethyloctacosane
CID 71323274
6-methylheptacosane
CID 22223776
15-methylhexatriacontane
CID 86002594
10,16-dimethyldotriacontane
CID 91748795
15-methyldotriacontane
CID 54168480
20-methyltetracontane
CID 20659070
8-methyloctacosane
CID 22224109
13,19-dimethylhentriacontane
CID 86136051
(6S)-6-methylnonadecane
CID 170848379
13,23-dimethylhexatriacontane
CID 6430392

Frequently Asked Questions

What is the IUPAC name of (7R)-7-methyltricosane?
The IUPAC name of (7R)-7-methyltricosane (CID 162971691) is (7R)-7-methyltricosane.
What is the SMILES notation for (7R)-7-methyltricosane?
The canonical SMILES for (7R)-7-methyltricosane is CCCCCCCCCCCCCCCC[C@H](C)CCCCCC.
What is the InChIKey of (7R)-7-methyltricosane?
The InChIKey is ULRDOMATUJWTEF-XMMPIXPASA-N. The full InChI is InChI=1S/C24H50/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-23-24(3)22-20-9-7-5-2/h24H,4-23H2,1-3H3/t24-/m1/s1.
What are the key properties of (7R)-7-methyltricosane?
(7R)-7-methyltricosane has a molecular weight of 338.66 g/mol, XLogP of 9.46, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-methyltricosane is sourced from PubChem (CID 162971691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).