Cas no 82144-78-3 (Pentadecanoicacid, 2-bromo-)
Pentadecanoicacid, 2-bromo- structure
Product Name:Pentadecanoicacid, 2-bromo-
CAS No:82144-78-3
MF:C15H29BrO2
MW:321.293564558029
CID:721057
PubChem ID:13615306
Update Time:2025-04-19
Pentadecanoicacid, 2-bromo- Chemical and Physical Properties
Names and Identifiers
-
- Pentadecanoicacid, 2-bromo-
- 2-BROMOPENTADECANOIC ACID
- 2-bromo-pentadecanoic acid
- 2-Brom-pentadecansaeure
- Pentadecanoic acid,2-bromo
- 82144-78-3
- DTXSID70545079
- SCHEMBL23829555
-
- Inchi： 1S/C15H29BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(16)15(17)18/h14H,2-13H2,1H3,(H,17,18)
- InChI Key： MUXQOFXMCVOPPW-UHFFFAOYSA-N
- SMILES： BrC(C(=O)O)CCCCCCCCCCCCC
Computed Properties
- Exact Mass: 320.13500
- Monoisotopic Mass: 320.13509g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 13
- Complexity: 195
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.3
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.30000
- LogP: 5.53560
Pentadecanoicacid, 2-bromo- Related Literature
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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