Home Aldehydes 5-Bromo-benzothiazole-2-carbaldehyde

5-Bromo-benzothiazole-2-carbaldehyde

CAS No.:
885279-64-1
Catalog Number:
AG004598
Molecular Formula:
C8H4BrNOS
Molecular Weight:
242.0925
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 96% (NMR)
1 week
United States
$190
- +
250mg
≥ 96% (NMR)
1 week
United States
$333
- +
1g
≥ 96% (NMR)
1 week
United States
$629
- +
5g
≥ 96% (NMR)
1 week
United States
$2383
- +
Product Description
Catalog Number:
AG004598
Chemical Name:
5-Bromo-benzothiazole-2-carbaldehyde
CAS Number:
885279-64-1
Molecular Formula:
C8H4BrNOS
Molecular Weight:
242.0925
MDL Number:
MFCD06738771
IUPAC Name:
5-bromo-1,3-benzothiazole-2-carbaldehyde
InChI:
InChI=1S/C8H4BrNOS/c9-5-1-2-7-6(3-5)10-8(4-11)12-7/h1-4H
InChI Key:
NQPMLGVPEPOVRW-UHFFFAOYSA-N
SMILES:
O=Cc1nc2c(s1)ccc(c2)Br
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.92g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.09g/mol
Monoisotopic Mass:
240.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties