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1260683-60-0 | Ethanone, 1-(2-amino-4-hydroxy-3-methoxyphenyl)-
CAS No: 1260683-60-0 Catalog No: AG000R33 MDL No:
Product Description
Catalog Number:
AG000R33
Chemical Name:
Ethanone, 1-(2-amino-4-hydroxy-3-methoxyphenyl)-
CAS Number:
1260683-60-0
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
IUPAC Name:
1-(2-amino-4-hydroxy-3-methoxyphenyl)ethanone
InChI:
InChI=1S/C9H11NO3/c1-5(11)6-3-4-7(12)9(13-2)8(6)10/h3-4,12H,10H2,1-2H3
InChI Key:
DLPKUYALAOIGBP-UHFFFAOYSA-N
SMILES:
COc1c(O)ccc(c1N)C(=O)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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