Home Nitriles 2-Amino-4-fluoro-1,3-benzothiazole-6-carbonitrile

2-Amino-4-fluoro-1,3-benzothiazole-6-carbonitrile

CAS No.:
1427448-37-0
Catalog Number:
AG01FL7K
Molecular Formula:
C8H4FN3S
Molecular Weight:
193.2009
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01FL7K
Chemical Name:
2-Amino-4-fluoro-1,3-benzothiazole-6-carbonitrile
CAS Number:
1427448-37-0
Molecular Formula:
C8H4FN3S
Molecular Weight:
193.2009
MDL Number:
MFCD23705710
IUPAC Name:
2-amino-4-fluoro-1,3-benzothiazole-6-carbonitrile
InChI:
InChI=1S/C8H4FN3S/c9-5-1-4(3-10)2-6-7(5)12-8(11)13-6/h1-2H,(H2,11,12)
InChI Key:
HQJWVMZREMMKQY-UHFFFAOYSA-N
SMILES:
Nc1nc2c(s1)cc(cc2F)C#N
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.011g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.199g/mol
Monoisotopic Mass:
193.011g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties