Home Halogens 3-(2-bromoethyl)-1,2-benzothiazole

3-(2-bromoethyl)-1,2-benzothiazole

CAS No.:
1935987-70-4
Catalog Number:
AG01C49H
Molecular Formula:
C9H8BrNS
Molecular Weight:
242.1355
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Product Description
Catalog Number:
AG01C49H
Chemical Name:
3-(2-bromoethyl)-1,2-benzothiazole
CAS Number:
1935987-70-4
Molecular Formula:
C9H8BrNS
Molecular Weight:
242.1355
MDL Number:
MFCD29991304
IUPAC Name:
3-(2-bromoethyl)-1,2-benzothiazole
InChI:
InChI=1S/C9H8BrNS/c10-6-5-8-7-3-1-2-4-9(7)12-11-8/h1-4H,5-6H2
InChI Key:
SNDWYLIKMOUFFZ-UHFFFAOYSA-N
SMILES:
BrCCc1nsc2c1cccc2
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.956g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.134g/mol
Monoisotopic Mass:
240.956g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties