Basic information
- CAS
54159-46-5- Standard SMILES
C=C(C)C(O)CC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CCC=C(C)C- InChIKey
JLUBMMAQMKVTGL-RLROCYJYSA-N- Molecular formula
- C30H50O
- Average molar mass
- 426.7 g/mol
- Monoisotopic mass
- 426.38616621
Names & identifiers
- Preferred name
- (6E,10E,14E,18E)-2,6,10,15,19,23-Hexamethyl-1,6,10,14,18,22-tetracosahexaen-3-ol
- IUPAC
- (6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-1,6,10,14,18,22-hexaen-3-ol
Names & synonyms
97232-74-1RefChem:1050684(6E,10E,14E,18E)-2,6,10,15,19,23-Hexamethyl-1,6,10,14,18,22-tetracosahexaen-3-olEINECS 306-416-1(E,E,E,E,E,E)-(1)-2,6,10,15,19,23-Hexamethyltetracosa-1,6,10,14,18,22-hexaen-3-ol1,6,10,14,18,22-Tetracosahexaen-3-ol, 2,6,10,15,19,23-hexamethyl-, (all-E)-(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-1,6,10,14,18,22-hexaen-3-olDTXSID00880682NS00096132(6E,10E,14E,18E)-2,6,10,15,19,23-Hexamethyl-1,6,10,14,18,22-tetracosahexaen-3-ol #54159-46-5
Database identifiers
- CAS
54159-46-5、97232-74-1- PubChem CID
- 5366014
- DTXSID
DTXSID00880682- EC Number
- 306-416-1
- Nikkaji
- J1.955.553D、J2.116.796G
Properties
Computed structural properties
- XLogP
- 10.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 16
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 663
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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