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Home Aminos Ethanone, 1-(2-amino-6-benzothiazolyl)-, oxime (9CI)

Ethanone, 1-(2-amino-6-benzothiazolyl)-, oxime (9CI)

CAS No.:
50851-05-3
Catalog Number:
AG00DTBJ
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
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Product Description
Catalog Number:
AG00DTBJ
Chemical Name:
Ethanone, 1-(2-amino-6-benzothiazolyl)-, oxime (9CI)
CAS Number:
50851-05-3
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
MDL Number:
MFCD18827775
IUPAC Name:
N-[1-(2-amino-1,3-benzothiazol-6-yl)ethylidene]hydroxylamine
InChI:
InChI=1S/C9H9N3OS/c1-5(12-13)6-2-3-7-8(4-6)14-9(10)11-7/h2-4,13H,1H3,(H2,10,11)
InChI Key:
ZQTZTDPTMOJPDU-UHFFFAOYSA-N
SMILES:
ON=C(c1ccc2c(c1)sc(n2)N)C
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2  
Properties