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Home Other Building Blocks 5-Methoxy-1-indanone-3-acetic acid

5-Methoxy-1-indanone-3-acetic acid

CAS No.:
24467-92-3
Catalog Number:
AG002O8L
Molecular Formula:
C12H12O4
Molecular Weight:
220.2213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%(HPLC)
In Stock USA
United States
$129
- +
1g
95%(HPLC)
In Stock USA
United States
$321
- +
5g
95%(HPLC)
In Stock USA
United States
$1119
- +
Product Description
Catalog Number:
AG002O8L
Chemical Name:
5-Methoxy-1-indanone-3-acetic acid
CAS Number:
24467-92-3
Molecular Formula:
C12H12O4
Molecular Weight:
220.2213
MDL Number:
MFCD00003787
IUPAC Name:
2-(6-methoxy-3-oxo-1,2-dihydroinden-1-yl)acetic acid
InChI:
InChI=1S/C12H12O4/c1-16-8-2-3-9-10(6-8)7(4-11(9)13)5-12(14)15/h2-3,6-7H,4-5H2,1H3,(H,14,15)
InChI Key:
QOTZOFGBBCMWEP-UHFFFAOYSA-N
SMILES:
COc1cc2C(CC(=O)O)CC(=O)c2cc1
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.224g/mol
Monoisotopic Mass:
220.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties