Home Nitros 1-(4-Hydroxy-5-Methoxy-2-nitrophenyl)ethanone

1-(4-Hydroxy-5-Methoxy-2-nitrophenyl)ethanone

CAS No.:
418759-58-7
Catalog Number:
AG00D7UT
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
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Product Description
Catalog Number:
AG00D7UT
Chemical Name:
1-(4-Hydroxy-5-Methoxy-2-nitrophenyl)ethanone
CAS Number:
418759-58-7
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD27996347
IUPAC Name:
1-(4-hydroxy-5-methoxy-2-nitrophenyl)ethanone
InChI:
InChI=1S/C9H9NO5/c1-5(11)6-3-9(15-2)8(12)4-7(6)10(13)14/h3-4,12H,1-2H3
InChI Key:
GZOJFKIFPFUTFG-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)C)c(cc1O)[N+](=O)[O-]
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.173g/mol
Monoisotopic Mass:
211.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties