Cas no 62477-17-2 (Methanone, bis(4-amino-3,5-dibromophenyl)-)
62477-17-2 structure
Product Name:Methanone, bis(4-amino-3,5-dibromophenyl)-
CAS No:62477-17-2
MF:C13H8Br4N2O
MW:527.831419944763
CID:443512
PubChem ID:21888799
Update Time:2025-04-19
Methanone, bis(4-amino-3,5-dibromophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, bis(4-amino-3,5-dibromophenyl)-
- bis(4-amino-3,5-dibromophenyl)methanone
- 62477-17-2
- SCHEMBL5981761
- DTXSID80619477
-
- Inchi： 1S/C13H8Br4N2O/c14-7-1-5(2-8(15)11(7)18)13(20)6-3-9(16)12(19)10(17)4-6/h1-4H,18-19H2
- InChI Key： FDNPDWWHMLVALM-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C=C(C=1)C(C1C=C(C(=C(C=1)Br)N)Br)=O)Br)N
Computed Properties
- Exact Mass: 523.73694
- Monoisotopic Mass: 523.73701g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 314
- 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: 4.7
- Topological Polar Surface Area: 69.1?2
Experimental Properties
- PSA: 69.11
Methanone, bis(4-amino-3,5-dibromophenyl)- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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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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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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