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4882-90-0 | 3-[(6-Ethoxy-2-benzothiazolyl)azo]-2,4-pentanedione
CAS No: 4882-90-0 Catalog No: AG00DTFJ MDL No:
Product Description
Catalog Number:
AG00DTFJ
Chemical Name:
3-[(6-Ethoxy-2-benzothiazolyl)azo]-2,4-pentanedione
CAS Number:
4882-90-0
IUPAC Name:
3-[(6-ethoxy-1,3-benzothiazol-2-yl)diazenyl]pentane-2,4-dione
InChI:
InChI=1S/C14H15N3O3S/c1-4-20-10-5-6-11-12(7-10)21-14(15-11)17-16-13(8(2)18)9(3)19/h5-7,13H,4H2,1-3H3
InChI Key:
JFPHQUYDPNVDHM-UHFFFAOYSA-N
NSC Number:
306777
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.083g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.352g/mol
Monoisotopic Mass:
305.083g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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