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13972-90-2 | 3H-Phenoxazin-3-one, 7-(dimethylamino)-1-hydroxy-
CAS No: 13972-90-2 Catalog No: AG001BLF MDL No:
Product Description
Catalog Number:
AG001BLF
Chemical Name:
3H-Phenoxazin-3-one, 7-(dimethylamino)-1-hydroxy-
CAS Number:
13972-90-2
Molecular Formula:
C14H12N2O3
Molecular Weight:
256.2567
IUPAC Name:
7-(dimethylamino)-1-hydroxyphenoxazin-3-one
InChI:
InChI=1S/C14H12N2O3/c1-16(2)8-3-4-10-12(5-8)19-13-7-9(17)6-11(18)14(13)15-10/h3-7,18H,1-2H3
InChI Key:
CYFRITYDUQNFTP-UHFFFAOYSA-N
SMILES:
O=c1cc(O)c2c(c1)oc1c(n2)ccc(c1)N(C)C
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.261g/mol
Monoisotopic Mass:
256.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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