200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1247021-61-9
1247021-61-9 | Acetic acid, 2-[(2-fluoro-6-nitrophenyl)thio]-
CAS No: 1247021-61-9 Catalog No: AG000MNF MDL No:MFCD22573544
Product Description
Catalog Number:
AG000MNF
Chemical Name:
Acetic acid, 2-[(2-fluoro-6-nitrophenyl)thio]-
CAS Number:
1247021-61-9
Molecular Formula:
C8H6FNO4S
Molecular Weight:
231.2009
MDL Number:
MFCD22573544
IUPAC Name:
2-(2-fluoro-6-nitrophenyl)sulfanylacetic acid
InChI:
InChI=1S/C8H6FNO4S/c9-5-2-1-3-6(10(13)14)8(5)15-4-7(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
ONSYTFOJBCXYCB-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1c(F)cccc1[N+](=O)[O-]
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.197g/mol
Monoisotopic Mass:
231g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.