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Cis-tert-butyl 3-(4-nitrophenyl)aziridine-2-carboxylate

CAS No.:
1431364-32-7
Catalog Number:
AG00HWT6
Molecular Formula:
C13H16N2O4
Molecular Weight:
264.2771
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
In Stock USA
United States
$158
- +
500mg
In Stock USA
United States
$248
- +
1g
In Stock USA
United States
$401
- +
2.5g
In Stock USA
United States
$748
- +
5g
In Stock USA
United States
$1165
- +
10g
In Stock USA
United States
$1860
- +
Product Description
Catalog Number:
AG00HWT6
Chemical Name:
Cis-tert-butyl 3-(4-nitrophenyl)aziridine-2-carboxylate
CAS Number:
1431364-32-7
Molecular Formula:
C13H16N2O4
Molecular Weight:
264.2771
MDL Number:
MFCD24368289
IUPAC Name:
tert-butyl (2R,3R)-3-(4-nitrophenyl)aziridine-2-carboxylate
InChI:
InChI=1S/C13H16N2O4/c1-13(2,3)19-12(16)11-10(14-11)8-4-6-9(7-5-8)15(17)18/h4-7,10-11,14H,1-3H3/t10-,11-/m1/s1
InChI Key:
JXJGFVMVUVDWNV-GHMZBOCLSA-N
SMILES:
O=C([C@@H]1N[C@@H]1c1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Properties
Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
264.111g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.281g/mol
Monoisotopic Mass:
264.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties