Cas no 676578-10-2 (1,10-Phenanthroline, 3,8-dibromo-2-methyl-)
676578-10-2 structure
Product Name:1,10-Phenanthroline, 3,8-dibromo-2-methyl-
CAS No:676578-10-2
MF:C13H8Br2N2
MW:352.024021148682
CID:1725320
PubChem ID:12104724
Update Time:2025-04-21
1,10-Phenanthroline, 3,8-dibromo-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,10-Phenanthroline, 3,8-dibromo-2-methyl-
- 3,8-dibromo-2-methyl-1,10-phenanthroline
- DTXSID00477652
- 676578-10-2
- 2-Methyl-3,8-dibromo-1,10-phenanthroline
-
- Inchi: 1S/C13H8Br2N2/c1-7-11(15)5-9-3-2-8-4-10(14)6-16-12(8)13(9)17-7/h2-6H,1H3
- InChI Key: AYMQLNGTPOSRGH-UHFFFAOYSA-N
- SMILES: BrC1=C(C)N=C2C3C(=CC(=CN=3)Br)C=CC2=C1
Computed Properties
- Exact Mass: 349.90544
- Monoisotopic Mass: 349.90542g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 287
- 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: 4.2
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
1,10-Phenanthroline, 3,8-dibromo-2-methyl- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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