Home Halogens tert-butyl 2-(4,5-dibromo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate

tert-butyl 2-(4,5-dibromo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate

CAS No.:
1240893-76-8
Catalog Number:
AG009CLD
Molecular Formula:
C12H17Br2N3O2
Molecular Weight:
395.0903
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG009CLD
Chemical Name:
tert-butyl 2-(4,5-dibromo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate
CAS Number:
1240893-76-8
Molecular Formula:
C12H17Br2N3O2
Molecular Weight:
395.0903
MDL Number:
MFCD20483136
IUPAC Name:
tert-butyl (2S)-2-(4,5-dibromo-1H-imidazol-2-yl)pyrrolidine-1-carboxylate
InChI:
InChI=1S/C12H17Br2N3O2/c1-12(2,3)19-11(18)17-6-4-5-7(17)10-15-8(13)9(14)16-10/h7H,4-6H2,1-3H3,(H,15,16)/t7-/m0/s1
InChI Key:
OMPRRUIFFXCQAQ-ZETCQYMHSA-N
SMILES:
O=C(N1CCC[C@H]1c1[nH]c(c(n1)Br)Br)OC(C)(C)C
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
394.967g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.095g/mol
Monoisotopic Mass:
392.969g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties