Home Aminos 7-Anilino-3-diethylamino-6-methyl fluoran

7-Anilino-3-diethylamino-6-methyl fluoran

CAS No.:
29512-49-0
Catalog Number:
AG0034DS
Molecular Formula:
C31H28N2O3
Molecular Weight:
476.5656
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$38
- +
25g
98%
In Stock USA
United States
$125
- +
100g
98%
In Stock USA
United States
$313
- +
Product Description
Catalog Number:
AG0034DS
Chemical Name:
7-Anilino-3-diethylamino-6-methyl fluoran
CAS Number:
29512-49-0
Molecular Formula:
C31H28N2O3
Molecular Weight:
476.5656
MDL Number:
MFCD00603523
IUPAC Name:
2'-anilino-6'-(diethylamino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one
InChI:
InChI=1S/C31H28N2O3/c1-4-33(5-2)22-15-16-25-29(18-22)35-28-17-20(3)27(32-21-11-7-6-8-12-21)19-26(28)31(25)24-14-10-9-13-23(24)30(34)36-31/h6-19,32H,4-5H2,1-3H3
InChI Key:
WQFYAGVHZYFXDO-UHFFFAOYSA-N
SMILES:
CCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)cc(c(c1)C)Nc1ccccc1)CC
EC Number:
249-676-0
Properties
Complexity:
780  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
476.21g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
476.576g/mol
Monoisotopic Mass:
476.21g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9  
Properties