Cas no 25939-12-2 (Benzenecarbohydrazonoylchloride, 4-bromo-N-phenyl-)
25939-12-2 structure
Product Name:Benzenecarbohydrazonoylchloride, 4-bromo-N-phenyl-
CAS No:25939-12-2
MF:C13H10BrClN2
MW:309.588901042938
CID:271354
PubChem ID:33247
Update Time:2025-04-19
Benzenecarbohydrazonoylchloride, 4-bromo-N-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarbohydrazonoylchloride, 4-bromo-N-phenyl-
- 4-Bromo-N-phenylbenzenecarbohydrazonoyl chloride
- 25939-12-2
- 4-bromo-benzoyl chloride phenylhydrazone
- DTXSID401235729
- SCHEMBL11673953
-
- Inchi： 1S/C13H10BrClN2/c14-11-8-6-10(7-9-11)13(15)17-16-12-4-2-1-3-5-12/h1-9,16H
- InChI Key： XQAFGQJURJIHJD-UHFFFAOYSA-N
- SMILES： BrC1C=CC(C(=NNC2C=CC=CC=2)Cl)=CC=1
Computed Properties
- Exact Mass: 307.9717
- Monoisotopic Mass: 307.972
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 256
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 24.4A^2
- XLogP3: 5.3
Experimental Properties
- Density: 1.43
- Boiling Point: 384.5°Cat760mmHg
- Flash Point: 186.3°C
- Refractive Index: 1.617
- PSA: 24.39
Benzenecarbohydrazonoylchloride, 4-bromo-N-phenyl- Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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