Home Halogens 6-bromo-2-(difluoromethyl)-1,3-benzothiazole

6-bromo-2-(difluoromethyl)-1,3-benzothiazole

CAS No.:
1644664-05-0
Catalog Number:
AG01DVSS
Molecular Formula:
C8H4BrF2NS
Molecular Weight:
264.0899
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Product Description
Catalog Number:
AG01DVSS
Chemical Name:
6-bromo-2-(difluoromethyl)-1,3-benzothiazole
CAS Number:
1644664-05-0
Molecular Formula:
C8H4BrF2NS
Molecular Weight:
264.0899
MDL Number:
MFCD28537295
IUPAC Name:
6-bromo-2-(difluoromethyl)-1,3-benzothiazole
InChI:
InChI=1S/C8H4BrF2NS/c9-4-1-2-5-6(3-4)13-8(12-5)7(10)11/h1-3,7H
InChI Key:
FQYOIJAUQOJMBD-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)sc(n2)C(F)F
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.922g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.088g/mol
Monoisotopic Mass:
262.922g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties