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56864-80-3 | Benzothiazole, 2,3-dihydro-3-methyl-2-(phenylmethyl)- (9CI)
CAS No: 56864-80-3 Catalog No: AG00EOBZ MDL No:
Product Description
Catalog Number:
AG00EOBZ
Chemical Name:
Benzothiazole, 2,3-dihydro-3-methyl-2-(phenylmethyl)- (9CI)
CAS Number:
56864-80-3
IUPAC Name:
2-benzyl-3-methyl-2H-1,3-benzothiazole
InChI:
InChI=1S/C15H15NS/c1-16-13-9-5-6-10-14(13)17-15(16)11-12-7-3-2-4-8-12/h2-10,15H,11H2,1H3
InChI Key:
HDZPTKFZNASYQJ-UHFFFAOYSA-N
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.093g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.352g/mol
Monoisotopic Mass:
241.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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