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Home Nitros (4-Fluoro-3-nitro-benzyl)-carbamic acid tert-butyl ester

(4-Fluoro-3-nitro-benzyl)-carbamic acid tert-butyl ester

CAS No.:
885280-67-1
Catalog Number:
AG0045QB
Molecular Formula:
C12H15FN2O4
Molecular Weight:
270.2569
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 95%
1 week
United States
$213
- +
250mg
95%
1 week
United States
$296
- +
1g
≥ 95%
1 week
United States
$842
- +
Product Description
Catalog Number:
AG0045QB
Chemical Name:
(4-Fluoro-3-nitro-benzyl)-carbamic acid tert-butyl ester
CAS Number:
885280-67-1
Molecular Formula:
C12H15FN2O4
Molecular Weight:
270.2569
MDL Number:
MFCD06658388
IUPAC Name:
tert-butyl N-[(4-fluoro-3-nitrophenyl)methyl]carbamate
InChI:
InChI=1S/C12H15FN2O4/c1-12(2,3)19-11(16)14-7-8-4-5-9(13)10(6-8)15(17)18/h4-6H,7H2,1-3H3,(H,14,16)
InChI Key:
WRMNFPXJSFBABQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccc(c(c1)[N+](=O)[O-])F
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.102g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.26g/mol
Monoisotopic Mass:
270.102g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties