Home Halogens 1-(5-bromo-2-hydroxy-3-methoxyphenyl)ethan-1-one

1-(5-bromo-2-hydroxy-3-methoxyphenyl)ethan-1-one

CAS No.:
99548-59-1
Catalog Number:
AG01BBKS
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BBKS
Chemical Name:
1-(5-bromo-2-hydroxy-3-methoxyphenyl)ethan-1-one
CAS Number:
99548-59-1
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD29906767
IUPAC Name:
1-(5-bromo-2-hydroxy-3-methoxyphenyl)ethanone
InChI:
InChI=1S/C9H9BrO3/c1-5(11)7-3-6(10)4-8(13-2)9(7)12/h3-4,12H,1-2H3
InChI Key:
GXFIRNPQAMNVEZ-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cc(c1O)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:
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:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties