Name: Name:Ethanone, 1-(2-hydroxy-4-Methoxy-5-nitrophenyl)-
Brand: Angene
SKU: AG0094WU
Rating: 90 (10 reviews)

Ethanone, 1-(2-hydroxy-4-Methoxy-5-nitrophenyl)-

CAS No.:

102877-53-2

Catalog Number:

AG0094WU

Molecular Formula:

C9H9NO5

Molecular Weight:

211.1715

Catalog Number:

AG0094WU

Chemical Name:

Ethanone, 1-(2-hydroxy-4-Methoxy-5-nitrophenyl)-

CAS Number:

102877-53-2

Molecular Formula:

C9H9NO5

Molecular Weight:

211.1715

MDL Number:

MFCD00100632

IUPAC Name:

1-(2-hydroxy-4-methoxy-5-nitrophenyl)ethanone

InChI:

InChI=1S/C9H9NO5/c1-5(11)6-3-7(10(13)14)9(15-2)4-8(6)12/h3-4,12H,1-2H3

InChI Key:

UGMBXUXKKCTLHR-UHFFFAOYSA-N

SMILES:

COc1cc(O)c(cc1[N+](=O)[O-])C(=O)C

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

211.048g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

211.173g/mol

Monoisotopic Mass:

211.048g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6