Home Nitros 2-(3-methoxy-4-nitrophenoxy)acetic acid

2-(3-methoxy-4-nitrophenoxy)acetic acid

CAS No.:
1221724-83-9
Catalog Number:
AG019XWV
Molecular Formula:
C9H9NO6
Molecular Weight:
227.1709
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Product Description
Catalog Number:
AG019XWV
Chemical Name:
2-(3-methoxy-4-nitrophenoxy)acetic acid
CAS Number:
1221724-83-9
Molecular Formula:
C9H9NO6
Molecular Weight:
227.1709
MDL Number:
MFCD13368235
IUPAC Name:
2-(3-methoxy-4-nitrophenoxy)acetic acid
InChI:
InChI=1S/C9H9NO6/c1-15-8-4-6(16-5-9(11)12)2-3-7(8)10(13)14/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
YOVQHOGVUQNYHO-UHFFFAOYSA-N
SMILES:
COc1cc(OCC(=O)O)ccc1[N+](=O)[O-]
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.043g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.172g/mol
Monoisotopic Mass:
227.043g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties