2,4-Difluoro-6-hydroxybenzoic acid

CAT: 0127-PC1003768-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-PC1003768-01Size:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

189283-54-3

MDL Number

MFCD06203215

Purity

95%

Smiles

O=C(O)C1=C(O)C=C(F)C=C1F

Chemical Information

2,4-Difluoro-6-hydroxybenzoic acid

CAS Number	189283-54-3
PubChem CID	22116788
IUPAC Name	2,4-difluoro-6-hydroxybenzoic acid
Molecular Formula	C7H4F2O3
Molecular Weight	174.10
XLogP	1.8
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	185

SMILES

C1=C(C=C(C(=C1O)C(=O)O)F)F

InChI

InChI=1S/C7H4F2O3/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,10H,(H,11,12)

InChIKey

DHJRFSOFNFQKJE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 189283-54-3

CID: 22116788

Formula: C7H4F2O3

MW: 174.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	174.10
XLogP3	1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	174.01285031
Monoisotopic Mass	174.01285031
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	185
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC8321-01	2,6-Difluoro-4-hydroxybenzoic acid
PC1139-01	3,6-Difluoro-2-hydroxybenzoic acid
PC1133-01	2,6-Difluoro-3-hydroxybenzoic acid
PC1114	2,3-Difluoro-6-hydroxybenzoic acid
PC1022320-01	6-bromo-2,4-difluoro-3-hydroxybenzoic acid
PC6148	2-Chloro-3,6-difluoro-4-hydroxybenzoic acid
PC1022315	2,4-difluoro-5-hydroxybenzoic acid
PC901612-01	2,4-difluoro-3-hydroxybenzoic acid
PC1004404-01	2,5-Difluoro-4-hydroxybenzoic acid
PC0867-01	2,3-Difluoro-4-hydroxybenzoic acid

Catalog	Name
sc-482467	2,6-Difluoro-4-hydroxybenzoic acid
TRC-D446117-25MG	2,6-Difluoro-4-hydroxybenzoic-d2 Acid
420830-01	2,6-Difluoro-3-hydroxybenzoic acid
427573-01	3,6-Difluoro-2-hydroxybenzoic acid
FD67619-01	2,6-Difluoro-4-hydroxybenzoic acid methyl ester
abx182964-01	2,3-Difluoro-4-hydroxybenzoic acid
FIA53331-01	4,5-Difluoro-2-hydroxybenzoic acid
FD67029-01	3,6-Difluoro-2-hydroxybenzoic acid methyl ester
sc-482624	3,5-Difluoro-4-hydroxybenzoic acid
FD67838-01	4,5-Difluoro-3-hydroxybenzoic acid