Cas no 58196-28-4 (Pentacosanal)
Pentacosanal structure
Product Name:Pentacosanal
CAS No:58196-28-4
MF:C25H50O
MW:366.663908481598
CID:386707
PubChem ID:181174
Update Time:2025-04-19
Pentacosanal Chemical and Physical Properties
Names and Identifiers
-
- Pentacosanal
- DTXSID50206939
- n-Pentacosanal
- SCHEMBL2173636
- LMFA06000106
- CHEBI:188048
- HAGKFWXVDSAFHB-UHFFFAOYSA-N
- 58196-28-4
-
- Inchi： 1S/C25H50O/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/h25H,2-24H2,1H3
- InChI Key： HAGKFWXVDSAFHB-UHFFFAOYSA-N
- SMILES： O=CCCCCCCCCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 366.3864
- Monoisotopic Mass: 366.386166214g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 26
- Rotatable Bond Count: 23
- Complexity: 249
- 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: 11.9
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Pentacosanal Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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