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207744-81-8 | Benzothiazole, 2-(trimethyloxiranyl)-, (-)- (9CI)
CAS No: 207744-81-8 Catalog No: AG00CFSG MDL No:
Product Description
Catalog Number:
AG00CFSG
Chemical Name:
Benzothiazole, 2-(trimethyloxiranyl)-, (-)- (9CI)
CAS Number:
207744-81-8
IUPAC Name:
2-(2,3,3-trimethyloxiran-2-yl)-1,3-benzothiazole
InChI:
InChI=1S/C12H13NOS/c1-11(2)12(3,14-11)10-13-8-6-4-5-7-9(8)15-10/h4-7H,1-3H3
InChI Key:
MUWUDCYVRBYZRD-UHFFFAOYSA-N
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.302g/mol
Monoisotopic Mass:
219.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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