Home Other Building Blocks 2-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID

2-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID

CAS No.:
239080-01-4
Catalog Number:
AG00C1SE
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C1SE
Chemical Name:
2-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID
CAS Number:
239080-01-4
MDL Number:
MFCD00236349
IUPAC Name:
2-[2-(trifluoromethylsulfanyl)phenyl]acetic acid
InChI:
InChI=1S/C9H7F3O2S/c10-9(11,12)15-7-4-2-1-3-6(7)5-8(13)14/h1-4H,5H2,(H,13,14)
InChI Key:
FVVZHMXCYDAXJG-UHFFFAOYSA-N
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.012g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.208g/mol
Monoisotopic Mass:
236.012g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties