(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene

C27H46 — CID 5496711

IUPAC(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene
SMILESCC(C)=CCC/C=C/CC/C(C)=C\CC/C=C/CC/C=C/CCCC(C)C
InChIInChI=1S/C27H46/c1-25(2)21-17-13-10-8-6-7-9-11-15-19-23-27(5)24-20-16-12-14-18-22-26(3)4/h8-12,16,22-23,25H,6-7,13-15,17-21,24H2,1-5H3/b10-8+,11-9+,16-12+,27-23-
InChIKeyRPCZHDAKJAJKQV-RABMJZNOSA-N
MW370.67 g/mol
LogP9.51
Rot. Bonds16

About (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene

(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene (PubChem CID 5496711) has the molecular formula C27H46 and a molecular weight of 370.67 g/mol. Its IUPAC name is (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene.

Molecular Properties

Compound Name(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene
PubChem CID5496711
Molecular FormulaC27H46
Molecular Weight370.67 g/mol
Exact Mass370.36
IUPAC Name(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene
SMILESCC(C)=CCC/C=C/CC/C(C)=C\CC/C=C/CC/C=C/CCCC(C)C
InChIInChI=1S/C27H46/c1-25(2)21-17-13-10-8-6-7-9-11-15-19-23-27(5)24-20-16-12-14-18-22-26(3)4/h8-12,16,22-23,25H,6-7,13-15,17-21,24H2,1-5H3/b10-8+,11-9+,16-12+,27-23-
InChIKeyRPCZHDAKJAJKQV-RABMJZNOSA-N
XLogP9.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.67
LogP ≤ 59.51
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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Frequently Asked Questions

What is the IUPAC name of (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene?
The IUPAC name of (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene (CID 5496711) is (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene.
What is the SMILES notation for (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene?
The canonical SMILES for (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene is CC(C)=CCC/C=C/CC/C(C)=C\CC/C=C/CC/C=C/CCCC(C)C.
What is the InChIKey of (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene?
The InChIKey is RPCZHDAKJAJKQV-RABMJZNOSA-N. The full InChI is InChI=1S/C27H46/c1-25(2)21-17-13-10-8-6-7-9-11-15-19-23-27(5)24-20-16-12-14-18-22-26(3)4/h8-12,16,22-23,25H,6-7,13-15,17-21,24H2,1-5H3/b10-8+,11-9+,16-12+,27-23-.
What are the key properties of (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene?
(6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene has a molecular weight of 370.67 g/mol, XLogP of 9.51, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10Z,14E,18E)-2,10,23-trimethyltetracosa-2,6,10,14,18-pentaene is sourced from PubChem (CID 5496711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).