Home Other Building Blocks 3-Hydroxy-1,8-naphthalic anhydride

3-Hydroxy-1,8-naphthalic anhydride

CAS No.:
23204-36-6
Catalog Number:
AG002MIT
Molecular Formula:
C12H6O4
Molecular Weight:
214.1736
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(T)
1 week
United States
$382
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Product Description
Catalog Number:
AG002MIT
Chemical Name:
3-Hydroxy-1,8-naphthalic anhydride
CAS Number:
23204-36-6
Molecular Formula:
C12H6O4
Molecular Weight:
214.1736
MDL Number:
MFCD00059759
IUPAC Name:
7-hydroxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione
InChI:
InChI=1S/C12H6O4/c13-7-4-6-2-1-3-8-10(6)9(5-7)12(15)16-11(8)14/h1-5,13H
InChI Key:
FKVNZFAMXGMPOU-UHFFFAOYSA-N
SMILES:
Oc1cc2cccc3c2c(c1)C(=O)OC3=O
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.027g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.176g/mol
Monoisotopic Mass:
214.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Molecular complexes of antipsychotic pharmaceutical parent molecule phenothiazine and unsaturated acid anhydrides. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20030501
Properties