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203524-87-2 | Ethanone, 2-bromo-1-(2-hydroxy-5-methoxyphenyl)-
CAS No: 203524-87-2 Catalog No: AG0028YJ MDL No:
Product Description
Catalog Number:
AG0028YJ
Chemical Name:
Ethanone, 2-bromo-1-(2-hydroxy-5-methoxyphenyl)-
CAS Number:
203524-87-2
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
IUPAC Name:
2-bromo-1-(2-hydroxy-5-methoxyphenyl)ethanone
InChI:
InChI=1S/C9H9BrO3/c1-13-6-2-3-8(11)7(4-6)9(12)5-10/h2-4,11H,5H2,1H3
InChI Key:
SHEOHUHOTMQILK-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1cc(OC)ccc1O
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.974g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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