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114091-04-2

114091-04-2 | Acetic acid, 2-(3-azido-5-methoxyphenoxy)-, methyl ester

CAS No: 114091-04-2 Catalog No: AG000AJT MDL No:

Product Description

Catalog Number:
AG000AJT
Chemical Name:
Acetic acid, 2-(3-azido-5-methoxyphenoxy)-, methyl ester
CAS Number:
114091-04-2
Molecular Formula:
C10H11N3O4
Molecular Weight:
237.2120
IUPAC Name:
methyl 2-(3-azido-5-methoxyphenoxy)acetate
InChI:
InChI=1S/C10H11N3O4/c1-15-8-3-7(12-13-11)4-9(5-8)17-6-10(14)16-2/h3-5H,6H2,1-2H3
InChI Key:
OJNCZIWPKWHZGP-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1cc(OCC(=O)OC)cc(c1)OC

Properties

Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.075g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.215g/mol
Monoisotopic Mass:
237.075g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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