Cas no 5365-79-7 (2-Nonadecanone,1-bromo-)
2-Nonadecanone,1-bromo- structure
Product Name:2-Nonadecanone,1-bromo-
CAS No:5365-79-7
MF:C19H37BrO
MW:361.400485754013
CID:384338
PubChem ID:237148
Update Time:2025-04-19
2-Nonadecanone,1-bromo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Nonadecanone,1-bromo-
- 1-bromononadecan-2-one
- 1-Brom-nonadecan-2-on
- 1-bromo-2-nonadecanone
- 1-bromo-nonadecan-2-one
- AC1L5Y62
- AC1Q27GC
- AR-1C2041
- Brommethyl-heptadecyl-keton
- CTK4J8534
- NSC40420
- SCHEMBL14644864
- DTXSID10285083
- 5365-79-7
- NSC-40420
-
- Inchi： 1S/C19H37BrO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21)18-20/h2-18H2,1H3
- InChI Key： VHAUVBNSUSTZKG-UHFFFAOYSA-N
- SMILES： BrCC(CCCCCCCCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 360.20291
- Monoisotopic Mass: 360.20278g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 17
- Complexity: 216
- 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: 9.2
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
- LogP: 7.21190
2-Nonadecanone,1-bromo- Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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