Cas no 551939-35-6 (Thiazole, 2,5-dibromo-4-nonyl- (9CI))
551939-35-6 structure
Product Name:Thiazole, 2,5-dibromo-4-nonyl- (9CI)
CAS No:551939-35-6
MF:C12H19Br2NS
MW:369.158960580826
CID:943510
PubChem ID:45117598
Update Time:2025-04-19
Thiazole, 2,5-dibromo-4-nonyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Thiazole, 2,5-dibromo-4-nonyl- (9CI)
- 2,5-Dibromo-4-nonyl-1,3-thiazole
- 551939-35-6
- Thiazole,2,5-dibromo-4-nonyl-(9ci)
- DTXSID40668648
-
- Inchi： 1S/C12H19Br2NS/c1-2-3-4-5-6-7-8-9-10-11(13)16-12(14)15-10/h2-9H2,1H3
- InChI Key： QHYXAYKIZLXYKI-UHFFFAOYSA-N
- SMILES： BrC1=C(CCCCCCCCC)N=C(S1)Br
Computed Properties
- Exact Mass: 366.96057
- Monoisotopic Mass: 366.96050g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 180
- 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: 7.4
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 12.89
Thiazole, 2,5-dibromo-4-nonyl- (9CI) Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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