200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 137234-92-5
137234-92-5 | Benzoic acid, 2,4,5-trifluoro-3-hydroxy-, methyl ester
CAS No: 137234-92-5 Catalog No: AG0012ZV MDL No:MFCD11226287
Product Description
Catalog Number:
AG0012ZV
Chemical Name:
Benzoic acid, 2,4,5-trifluoro-3-hydroxy-, methyl ester
CAS Number:
137234-92-5
Molecular Formula:
C8H5F3O3
Molecular Weight:
206.1187
MDL Number:
MFCD11226287
IUPAC Name:
methyl 2,4,5-trifluoro-3-hydroxybenzoate
InChI:
InChI=1S/C8H5F3O3/c1-14-8(13)3-2-4(9)6(11)7(12)5(3)10/h2,12H,1H3
InChI Key:
RGYDATSCTAJHIZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(c(c1F)O)F
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.019g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.12g/mol
Monoisotopic Mass:
206.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.