Cas no 56107-03-0 (Methanone, (4-bromo-3-nitrophenyl)phenyl-)
56107-03-0 structure
Product Name:Methanone, (4-bromo-3-nitrophenyl)phenyl-
CAS No:56107-03-0
MF:C13H8BrNO3
MW:306.111522674561
CID:349771
PubChem ID:3475180
Update Time:2025-04-19
Methanone, (4-bromo-3-nitrophenyl)phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (4-bromo-3-nitrophenyl)phenyl-
- (4-bromo-3-nitrophenyl)-phenylmethanone
- 4-Brom-3-nitro-benzophenon
- 4-bromo-3-nitro-benzophenone
- DTXSID10392822
- EU-0000948
- 4-BROMO-3-NITROBENZOPHENONE
- 56107-03-0
- (4-bromo-3-nitrophenyl)(phenyl)methanone
- SCHEMBL11466888
-
- Inchi： 1S/C13H8BrNO3/c14-11-7-6-10(8-12(11)15(17)18)13(16)9-4-2-1-3-5-9/h1-8H
- InChI Key： ONLOWPRDSVDQGH-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1[N+](=O)[O-])C(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 304.96900
- Monoisotopic Mass: 304.96876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 323
- 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: 3.8
- Topological Polar Surface Area: 62.9?2
Experimental Properties
- PSA: 62.89000
- LogP: 4.11150
Methanone, (4-bromo-3-nitrophenyl)phenyl- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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