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67694-77-3 | Benzothiazole, 4-(oxiranylmethoxy)- (9CI)
CAS No: 67694-77-3 Catalog No: AG00FZ56 MDL No:
Product Description
Catalog Number:
AG00FZ56
Chemical Name:
Benzothiazole, 4-(oxiranylmethoxy)- (9CI)
CAS Number:
67694-77-3
IUPAC Name:
4-(oxiran-2-ylmethoxy)-1,3-benzothiazole
InChI:
InChI=1S/C10H9NO2S/c1-2-8(13-5-7-4-12-7)10-9(3-1)14-6-11-10/h1-3,6-7H,4-5H2
InChI Key:
PJVDTCAXTWBXIW-UHFFFAOYSA-N
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.247g/mol
Monoisotopic Mass:
207.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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