Home Aldehydes 5-fluoro-1,3-benzothiazole-2-carbaldehyde

5-fluoro-1,3-benzothiazole-2-carbaldehyde

CAS No.:
139425-46-0
Catalog Number:
AG01BCY8
Molecular Formula:
C8H4FNOS
Molecular Weight:
181.1869
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Product Description
Catalog Number:
AG01BCY8
Chemical Name:
5-fluoro-1,3-benzothiazole-2-carbaldehyde
CAS Number:
139425-46-0
Molecular Formula:
C8H4FNOS
Molecular Weight:
181.1869
MDL Number:
MFCD23788131
IUPAC Name:
5-fluoro-1,3-benzothiazole-2-carbaldehyde
InChI:
InChI=1S/C8H4FNOS/c9-5-1-2-7-6(3-5)10-8(4-11)12-7/h1-4H
InChI Key:
OIPIPWSTKLCZOS-UHFFFAOYSA-N
SMILES:
O=Cc1nc2c(s1)ccc(c2)F
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.184g/mol
Monoisotopic Mass:
181g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties