Cas no 105946-57-4 (1,3-bis(3-bromophenyl)urea)
1,3-bis(3-bromophenyl)urea structure
Product Name:1,3-bis(3-bromophenyl)urea
CAS No:105946-57-4
MF:C13H10Br2N2O
MW:370.039301395416
CID:1165440
PubChem ID:13719103
Update Time:2025-04-20
1,3-bis(3-bromophenyl)urea Chemical and Physical Properties
Names and Identifiers
-
- 1,3-bis(3-bromophenyl)urea
- N,N'-bis-(3-bromo-phenyl)-urea
- CTK0D7324
- ACMC-20m9a6
- N,N'-Bis-(3-brom-phenyl)-harnstoff
- AGN-PC-00NP5D
- Urea, N,N'-bis(3-bromophenyl)-
- ZINC51354351
- STL012637
- 3.3'-Dibrom-carbanilid
- AKOS005673265
- N,N'-bis-(3-bromo-phenyl)-urea; CTK0D7324; ACMC-20m9a6; N,N'-Bis-(3-brom-phenyl)-harnstoff; AGN-PC-00NP5D; Urea, N,N'-bis(3-bromophenyl)-; ZINC51354351; STL012637; 3.3'-Dibrom-carbanilid; AKOS005673265;
- SCHEMBL19707566
- 105946-57-4
- N,N'-Bis(3-bromophenyl)urea
- 1,3-bis(m-bromophenyl) urea
- N,N'-bis(3-Bromoyphenyl)urea
- mBrPU
- DTXSID20547543
-
- Inchi： 1S/C13H10Br2N2O/c14-9-3-1-5-11(7-9)16-13(18)17-12-6-2-4-10(15)8-12/h1-8H,(H2,16,17,18)
- InChI Key： BFHFAXGAEDMUDI-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1)NC(NC1C=CC=C(C=1)Br)=O
Computed Properties
- Exact Mass: 367.916
- Monoisotopic Mass: 367.91599g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 262
- 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: 4.4
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 41.13
1,3-bis(3-bromophenyl)urea Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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