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30761-23-0 | 2(3H)-Benzothiazolone,3-methyl-,oxime(9CI)
CAS No: 30761-23-0 Catalog No: AG00BSME MDL No:
Product Description
Catalog Number:
AG00BSME
Chemical Name:
2(3H)-Benzothiazolone,3-methyl-,oxime(9CI)
CAS Number:
30761-23-0
IUPAC Name:
(NE)-N-(3-methyl-1,3-benzothiazol-2-ylidene)hydroxylamine
InChI:
InChI=1S/C8H8N2OS/c1-10-6-4-2-3-5-7(6)12-8(10)9-11/h2-5,11H,1H3/b9-8+
InChI Key:
IONNAMKZAMTVGD-CMDGGOBGSA-N
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
180.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.225g/mol
Monoisotopic Mass:
180.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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