Home Other Building Blocks 5-Hydroxy-6-methoxy-1-indanone

5-Hydroxy-6-methoxy-1-indanone

CAS No.:
127399-78-4
Catalog Number:
AG000X16
Molecular Formula:
C10H10O3
Molecular Weight:
178.1846
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG000X16
Chemical Name:
5-Hydroxy-6-methoxy-1-indanone
CAS Number:
127399-78-4
Molecular Formula:
C10H10O3
Molecular Weight:
178.1846
MDL Number:
MFCD11655879
IUPAC Name:
5-hydroxy-6-methoxy-2,3-dihydroinden-1-one
InChI:
InChI=1S/C10H10O3/c1-13-10-5-7-6(4-9(10)12)2-3-8(7)11/h4-5,12H,2-3H2,1H3
InChI Key:
ACECGHQDQWBTBM-UHFFFAOYSA-N
SMILES:
COc1cc2C(=O)CCc2cc1O
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.063g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.187g/mol
Monoisotopic Mass:
178.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties