4-Bromo-2-hydroxybenzoic acid 98% supplier in China CAS NO.1666-28-0

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1. Introduction of 4-Bromo-2-hydroxybenzoic acid

The 4-Bromo-2-hydroxybenzoic acid, with its CAS NO 1666-28-0, is a kind of Browm solid. It has synonyms of Salicylicacid, 4-bromo- (6CI,7CI,8CI);2-Hydroxy-4-bromobenzoic acid;NSC 109120;Benzoic acid, 4-bromo-2-hydroxy-;Salicylic acid, 4-bromo- and 4-Bromo-2-hydroxybenzoic acid. 4-Bromo-2-hydroxybenzoic acid should be stored in shady and cool warehouse.

2. Properties of 4-Bromo-2-hydroxybenzoic acid

(1) XLogP3 3.2  (2) H-Bond Donor 2  (3) H-Bond Acceptor 3
(4) Rotatable Bond Count 1 (5) Tautomer Count 4 (6) Exact Mass 215.942206
(7) MonoIsotopic Mass 215.942206 (8) Topological Polar Surface Area 57.5
(9) Heavy Atom Count 11  (10) Covalently-Bonded Unit Count 1
(11) Feature 3D Acceptor Count 2 (12) Feature 3D Donor Count 1
(13) Feature 3D Anion Count 1 (14) Feature 3D Hydrophobe Count 1
(15) Feature 3D Ring Count 1 (16) Effective Rotor Count 1
(17) Conformer Sampling RMSD 0.4 (18) CID Conformer Count 3
 

3. Structure descriptors of 4-Bromo-2-hydroxybenzoic acid

IUPAC Name: 4-bromo-2-hydroxybenzoic acid

InChI: InChI=1S/C7H5BrO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,(H,10,11)

InChIKey: FYAKLZKQJDBBKW-UHFFFAOYSA-N

Canonical SMILES : C1=CC(=C(C=C1Br)O)C(=O)O