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3301-79-9

3301-79-9 | 6-Carboxyfluorescein

CAS No: 3301-79-9 Catalog No: AG0038TE MDL No:MFCD00036873

Product Description

Catalog Number:
AG0038TE
Chemical Name:
6-Carboxyfluorescein
CAS Number:
3301-79-9
Molecular Formula:
C21H12O7
Molecular Weight:
376.3158
MDL Number:
MFCD00036873
IUPAC Name:
3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylic acid
InChI:
InChI=1S/C21H12O7/c22-11-2-5-14-17(8-11)27-18-9-12(23)3-6-15(18)21(14)16-7-10(19(24)25)1-4-13(16)20(26)28-21/h1-9,22-23H,(H,24,25)
InChI Key:
BZTDTCNHAFUJOG-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)Oc1c(C32OC(=O)c2c3cc(cc2)C(=O)O)ccc(c1)O

Properties

Complexity:
637  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.058g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
376.32g/mol
Monoisotopic Mass:
376.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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