Cas no 22725-63-9 (Triacontanal)
Triacontanal structure
Product Name:Triacontanal
CAS No:22725-63-9
MF:C30H60O
MW:436.796810150146
CID:290269
PubChem ID:3084375
Update Time:2025-04-19
Triacontanal Chemical and Physical Properties
Names and Identifiers
-
- Triacontanal
- 1-triacosanal
- AC1MJ2F7
- AG-E-65248
- CPD-7888
- CTK1A7702
- melissaldehyde
- melissic aldehyde
- n-Triacontanal
- Thiacontanal
- SCHEMBL15136035
- CGNVIRPGBUXJES-UHFFFAOYSA-N
- CHEBI:84946
- DTXSID30177259
- F81218
- V696E9G5E2
- 22725-63-9
- LMFA06000262
- Q27158211
- UNII-V696E9G5E2
-
- Inchi： 1S/C30H60O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31/h30H,2-29H2,1H3
- InChI Key： CGNVIRPGBUXJES-UHFFFAOYSA-N
- SMILES： O=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 436.4647
- Monoisotopic Mass: 436.464416533g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 31
- Rotatable Bond Count: 28
- Complexity: 312
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 14.6
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Triacontanal Related Literature
-
Samia Rabah,Kahina Kouachi,Patrícia A. B. Ramos,Ana Peixoto Gomes,Adelaide Almeida,Hayate Haddadi-Guemghar,Khodir Madani,Armando J. D. Silvestre,Sónia A. O. Santos Food Funct. 2020 11 5257
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