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1339909-51-1

1339909-51-1 | N-[(2-Nitrophenyl)methyl]oxetan-3-amine

CAS No: 1339909-51-1 Catalog No: AG01FCBE MDL No:

Product Description

Catalog Number:
AG01FCBE
Chemical Name:
N-[(2-Nitrophenyl)methyl]oxetan-3-amine
CAS Number:
1339909-51-1
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
IUPAC Name:
N-[(2-nitrophenyl)methyl]oxetan-3-amine
InChI:
InChI=1S/C10H12N2O3/c13-12(14)10-4-2-1-3-8(10)5-11-9-6-15-7-9/h1-4,9,11H,5-7H2
InChI Key:
VKUWVOMTTJAZNF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1CNC1COC1

Properties

Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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