Home Other Building Blocks 2,3,6-Trifluorocinnamic acid

2,3,6-Trifluorocinnamic acid

CAS No.:
230295-12-2
Catalog Number:
AG002LXQ
Molecular Formula:
C9H5F3O2
Molecular Weight:
202.1300
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95+%
1 week
United States
$24
- +
250mg
95+%
1 week
United States
$46
- +
1g
95+%
1 week
United States
$116
- +
Product Description
Catalog Number:
AG002LXQ
Chemical Name:
2,3,6-Trifluorocinnamic acid
CAS Number:
230295-12-2
Molecular Formula:
C9H5F3O2
Molecular Weight:
202.1300
MDL Number:
MFCD00061213
IUPAC Name:
(E)-3-(2,3,6-trifluorophenyl)prop-2-enoic acid
InChI:
InChI=1S/C9H5F3O2/c10-6-2-3-7(11)9(12)5(6)1-4-8(13)14/h1-4H,(H,13,14)/b4-1+
InChI Key:
OLYDUMMUGMYVHJ-DAFODLJHSA-N
SMILES:
OC(=O)C=Cc1c(F)ccc(c1F)F
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
202.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.132g/mol
Monoisotopic Mass:
202.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties