3,5-Difluoromandelic acid, 3,5-Difluoromandelic acid buy,3,5-Difluoromandelic acid suppliers, 3,5-Difluoromandelic acid price CAS NO.132741-31-2

The company covers an area of 98000 square meters, including a building area of 32000 square meters. In addition to being

equipped with consummated production and supporting facilities, the company has also been built with a new product R&D center.

1. Introduction of 3,5-Difluoromandelic acid

The 3,5-Difluoromandelic acid, with its CAS NO 132741-31-2, is a kind of powder. It has synonyms of (3,5-Difluorophenyl)(hydroxy)aceticacid. 3,5-Difluoromandelic acid should be stored in shady cool warehouse.

 

2. Properties of 3,5-Difluoromandelic acid

(1) XLogP3-AA 1  (2) H-Bond Don2  (3) H-Bond Accept5
(4) Rotatable Bond Count 2 (5) Exact Mass 188.0285 (6) MonoIsotopic Mass 188.0285
(7) Topological Polar Surface Area 57.5 (8) Heavy Atom Count 13  (9) Complexity 188 
(10) Undefined Atom Stereocenter Count 1  (11) Covalently-Bonded Unit Count 1
(12) Feature 3D AcceptCount 3  (13) Feature 3D DonCount 1
(14) Feature 3D Anion Count 1  (15) Feature 3D Ring Count 1 (16) Effective RotCount 2
(17) Conformer Sampling RMSD 0.6 (18) CID Conformer Count 5

3. Structure descriptors of 3,5-Difluoromandelic acid

IUPAC Name: 2-(3,5-difluorophenyl)-2-hydroxyacetic acid

InChI: InChI=1S/C8H6F2O3/c9-5-1-4(2-6(10)3-5)7(11)8(12)13/h1-3,7,11H,(H,12,13)

InChIKey: PHMLPPFFMSRWBK-UHFFFAOYSA-N

Canonical SMILES : C1=C(C=C(C=C1F)F)C(C(=O)O)O