(Z)-22-methyltricos-9-ene

C24H48 — CID 152752766

IUPAC(Z)-22-methyltricos-9-ene
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(C)C
InChIInChI=1S/C24H48/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(2)3/h11-12,24H,4-10,13-23H2,1-3H3/b12-11-
InChIKeyQLMMULNXTOYHNC-QXMHVHEDSA-N
MW336.65 g/mol
LogP9.24
Rot. Bonds19

About (Z)-22-methyltricos-9-ene

(Z)-22-methyltricos-9-ene (PubChem CID 152752766) has the molecular formula C24H48 and a molecular weight of 336.65 g/mol. Its IUPAC name is (Z)-22-methyltricos-9-ene.

Molecular Properties

Compound Name(Z)-22-methyltricos-9-ene
PubChem CID152752766
Molecular FormulaC24H48
Molecular Weight336.65 g/mol
Exact Mass336.38
IUPAC Name(Z)-22-methyltricos-9-ene
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(C)C
InChIInChI=1S/C24H48/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(2)3/h11-12,24H,4-10,13-23H2,1-3H3/b12-11-
InChIKeyQLMMULNXTOYHNC-QXMHVHEDSA-N
XLogP9.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.65
LogP ≤ 59.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methylhenicos-9-ene
CID 54211724
(E)-2-methylheptadec-7-ene
CID 173124832
(E)-2-methylheptadec-8-ene
CID 20541049
(Z)-11-methyldodec-5-ene
CID 159147265
(E)-2,15-dimethylhexadec-8-ene
CID 176630932
(Z)-2,15-dimethylhexadec-8-ene
CID 176630952
(Z)-2,16-dimethylheptadec-6-ene
CID 176630987
(Z)-2,11-dimethyldodec-6-ene;(E)-2,11-dimethyldodec-6-ene;(Z)-2,14-dimethylpentadec-6-ene;(E)-2,14-dimethylpentadec-6-ene
CID 161032897
(E)-2,16-dimethylheptadec-6-ene
CID 176630989
(E)-2,13-dimethyltetradec-7-ene
CID 176630990
10-methylundec-3-ene
CID 544769
12-methylicos-6-ene
CID 91498266

Frequently Asked Questions

What is the IUPAC name of (Z)-22-methyltricos-9-ene?
The IUPAC name of (Z)-22-methyltricos-9-ene (CID 152752766) is (Z)-22-methyltricos-9-ene.
What is the SMILES notation for (Z)-22-methyltricos-9-ene?
The canonical SMILES for (Z)-22-methyltricos-9-ene is CCCCCCCC/C=C\CCCCCCCCCCCC(C)C.
What is the InChIKey of (Z)-22-methyltricos-9-ene?
The InChIKey is QLMMULNXTOYHNC-QXMHVHEDSA-N. The full InChI is InChI=1S/C24H48/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(2)3/h11-12,24H,4-10,13-23H2,1-3H3/b12-11-.
What are the key properties of (Z)-22-methyltricos-9-ene?
(Z)-22-methyltricos-9-ene has a molecular weight of 336.65 g/mol, XLogP of 9.24, 19 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-22-methyltricos-9-ene is sourced from PubChem (CID 152752766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).