Cas no 90265-01-3 (Dodecanoic acid, 11,12-dibromo-)
90265-01-3 structure
Product Name:Dodecanoic acid, 11,12-dibromo-
CAS No:90265-01-3
MF:C12H22Br2O2
MW:358.109882831573
CID:790644
PubChem ID:13308695
Update Time:2025-04-19
Dodecanoic acid, 11,12-dibromo- Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid, 11,12-dibromo-
- 11,12-dibromododecanoic acid
- DTXSID60536178
- 90265-01-3
-
- Inchi： 1S/C12H22Br2O2/c13-10-11(14)8-6-4-2-1-3-5-7-9-12(15)16/h11H,1-10H2,(H,15,16)
- InChI Key： ONXSEKUMSXIUGC-UHFFFAOYSA-N
- SMILES： BrC(CBr)CCCCCCCCCC(=O)O
Computed Properties
- Exact Mass: 357.99661g/mol
- Monoisotopic Mass: 355.99866g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 11
- Complexity: 174
- 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: 5.1
- Topological Polar Surface Area: 37.3?2
Dodecanoic acid, 11,12-dibromo- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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