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17229-77-5 | Benzothiazole, 2-(2-methylpropyl)- (9CI)
CAS No: 17229-77-5 Catalog No: AG00AUZW MDL No:
Product Description
Catalog Number:
AG00AUZW
Chemical Name:
Benzothiazole, 2-(2-methylpropyl)- (9CI)
CAS Number:
17229-77-5
IUPAC Name:
2-(2-methylpropyl)-1,3-benzothiazole
InChI:
InChI=1S/C11H13NS/c1-8(2)7-11-12-9-5-3-4-6-10(9)13-11/h3-6,8H,7H2,1-2H3
InChI Key:
IWFLFDPYBRUZBR-UHFFFAOYSA-N
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.292g/mol
Monoisotopic Mass:
191.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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