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79714-85-5 | Benzothiazole, 2-[(3-methyl-2-butenyl)oxy]- (9CI)
CAS No: 79714-85-5 Catalog No: AG00GC6T MDL No:
Product Description
Catalog Number:
AG00GC6T
Chemical Name:
Benzothiazole, 2-[(3-methyl-2-butenyl)oxy]- (9CI)
CAS Number:
79714-85-5
IUPAC Name:
2-(3-methylbut-2-enoxy)-1,3-benzothiazole
InChI:
InChI=1S/C12H13NOS/c1-9(2)7-8-14-12-13-10-5-3-4-6-11(10)15-12/h3-7H,8H2,1-2H3
InChI Key:
HBKHIUZDVVFBKM-UHFFFAOYSA-N
Properties
Complexity:
238
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:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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