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29626-08-2 | 5,6-Dihydro-2-[(2-hydroxy-1-naphtyl)azo]-5,5-dimethylbenzothiazol-7(4H)-one
CAS No: 29626-08-2 Catalog No: AG00BQYZ MDL No:
Product Description
Catalog Number:
AG00BQYZ
Chemical Name:
5,6-Dihydro-2-[(2-hydroxy-1-naphtyl)azo]-5,5-dimethylbenzothiazol-7(4H)-one
CAS Number:
29626-08-2
IUPAC Name:
2-[(2-hydroxynaphthalen-1-yl)diazenyl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one
InChI:
InChI=1S/C19H17N3O2S/c1-19(2)9-13-17(15(24)10-19)25-18(20-13)22-21-16-12-6-4-3-5-11(12)7-8-14(16)23/h3-8,23H,9-10H2,1-2H3
InChI Key:
GRKHQUKIVIWXSM-UHFFFAOYSA-N
Properties
Complexity:
553
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.104g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.424g/mol
Monoisotopic Mass:
351.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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