Cas no 27988-64-3 (Poly(5-bru))
Poly(5-bru) structure
Product Name:Poly(5-bru)
CAS No:27988-64-3
MF:C9H12BrN2O9P
MW:403.077342987061
CID:255792
Update Time:2024-01-27
Poly(5-bru) Chemical and Physical Properties
Names and Identifiers
-
- Poly(5-bru)
- poly-5-bromouridylic acid
- 5'-Uridylic acid, 5-bromo-, homopolymer
- Poly(bu)
-
- Inchi： 1S/C9H12BrN2O9P/c10-3-1-12(9(16)11-7(3)15)8-6(14)5(13)4(21-8)2-20-22(17,18)19/h1,4-6,8,13-14H,2H2,(H,11,15,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
- InChI Key： IDPVUMJNEZFMNU-UAKXSSHOSA-N
- SMILES： P(OC[C@@H]1[C@@H](O)[C@@H](O)[C@H](N2C(=O)NC(=O)C(Br)=C2)O1)(O)(O)=O
Computed Properties
- Exact Mass: 401.946
- Monoisotopic Mass: 401.946
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 563
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 166A^2
Experimental Properties
- Density: 2.165
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.683
- PSA: 181.12000
- LogP: -1.97240
Poly(5-bru) Related Literature
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Thomas Pesnot,Gerd K. Wagner Org. Biomol. Chem. 2008 6 2884
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Wickliffe O. Wepukhulu,Vanessa L. Smiley,Bhargavi Vemulapalli,Jeffrey A. Smiley,Linda M. Phillips,Jeehiun K. Lee Org. Biomol. Chem. 2008 6 4533
-
Georgii V. Sidorov,Nikolai F. Myasoedov Russ. Chem. Rev. 1999 68 229
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T. K. Bradshaw,D. W. Hutchinson Chem. Soc. Rev. 1977 6 43
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