Home Nitros [2-hydroxy-3-(4-nitrophenoxy)propyl](methyl)amine

[2-hydroxy-3-(4-nitrophenoxy)propyl](methyl)amine

CAS No.:
133228-94-1
Catalog Number:
AG019XZZ
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
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Product Description
Catalog Number:
AG019XZZ
Chemical Name:
[2-hydroxy-3-(4-nitrophenoxy)propyl](methyl)amine
CAS Number:
133228-94-1
Molecular Formula:
C10H14N2O4
Molecular Weight:
226.2292
MDL Number:
MFCD11135129
IUPAC Name:
1-(methylamino)-3-(4-nitrophenoxy)propan-2-ol
InChI:
InChI=1S/C10H14N2O4/c1-11-6-9(13)7-16-10-4-2-8(3-5-10)12(14)15/h2-5,9,11,13H,6-7H2,1H3
InChI Key:
VXKBHPFLIUMGNB-UHFFFAOYSA-N
SMILES:
CNCC(COc1ccc(cc1)[N+](=O)[O-])O
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.232g/mol
Monoisotopic Mass:
226.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties