Home Nitros 2-(4-formyl-2-methoxy-5-nitrophenoxy)acetic acid

2-(4-formyl-2-methoxy-5-nitrophenoxy)acetic acid

CAS No.:
90429-09-7
Catalog Number:
AG01ABIL
Molecular Formula:
C10H9NO7
Molecular Weight:
255.1810
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Product Description
Catalog Number:
AG01ABIL
Chemical Name:
2-(4-formyl-2-methoxy-5-nitrophenoxy)acetic acid
CAS Number:
90429-09-7
Molecular Formula:
C10H9NO7
Molecular Weight:
255.1810
MDL Number:
MFCD11536175
IUPAC Name:
2-(4-formyl-2-methoxy-5-nitrophenoxy)acetic acid
InChI:
InChI=1S/C10H9NO7/c1-17-8-2-6(4-12)7(11(15)16)3-9(8)18-5-10(13)14/h2-4H,5H2,1H3,(H,13,14)
InChI Key:
OWVYIQJYENXHSX-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(cc1OCC(=O)O)[N+](=O)[O-]
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.038g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.182g/mol
Monoisotopic Mass:
255.038g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties