200,000+ products from a single source!
sales@angenechem.com
29512-46-7 | Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-(phenylamino)-
CAS No: 29512-46-7 Catalog No: AG002YLI MDL No:
Product Description
Catalog Number:
AG002YLI
Chemical Name:
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-(diethylamino)-2'-(phenylamino)-
CAS Number:
29512-46-7
Molecular Formula:
C30H26N2O3
Molecular Weight:
462.5390
IUPAC Name:
2'-anilino-6'-(diethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one
InChI:
InChI=1S/C30H26N2O3/c1-3-32(4-2)22-15-16-25-28(19-22)34-27-17-14-21(31-20-10-6-5-7-11-20)18-26(27)30(25)24-13-9-8-12-23(24)29(33)35-30/h5-19,31H,3-4H2,1-2H3
InChI Key:
SVTBGPICDZDBFU-UHFFFAOYSA-N
SMILES:
CCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)cc(cc1)Nc1ccccc1)CC
EC Number:
249-675-5
Properties
Complexity:
750
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
462.194g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
462.549g/mol
Monoisotopic Mass:
462.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.