4- (Dimethylamino) -2-hydroxybenzoic acid

CAT: 0127-OR1046190-01Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1046190-01Size:100 mg

Selected

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

Quick Request Actions

CAS Number

23050-91-1

MDL Number

MFCD00020262

Purity

95%

Smiles

O=C(O)C1=CC=C(N(C)C)C=C1O

Chemical Information

4-(Dimethylamino)salicylic acid

CAS Number	23050-91-1
PubChem CID	89978
IUPAC Name	4-(dimethylamino)-2-hydroxybenzoic acid
Molecular Formula	C9H11NO3
Molecular Weight	181.19
XLogP	2.1
Topological Polar Surface Area	60.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	193

SMILES

CN(C)C1=CC(=C(C=C1)C(=O)O)O

InChI

InChI=1S/C9H11NO3/c1-10(2)6-3-4-7(9(12)13)8(11)5-6/h3-5,11H,1-2H3,(H,12,13)

InChIKey

SJIDPEUJSIWFAE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 23050-91-1

CID: 89978

Formula: C9H11NO3

MW: 181.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.19
XLogP3	2.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	181.07389321
Monoisotopic Mass	181.07389321
Topological Polar Surface Area	60.8 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193
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
BUP18403-01	4-Hydroxybenzoic acid
OR923629-01	4-Hydroxybenzoic acid
OR51345	2-Cyano-4-hydroxybenzoic acid
OR2357-01	4-Chloro-2-hydroxybenzoic acid
OR400738-01	2-Bromo-4-hydroxybenzoic acid
OR59476	4-Acetamido-2-hydroxybenzoic acid
OR345112-01	2-Chloro-4-hydroxybenzoic acid
OR400408	4-Cyano-2-hydroxybenzoic acid
PC5723-01	4-Fluoro-2-hydroxybenzoic acid
OR1047537-01	4- (Chlorosulfonyl) -2-hydroxybenzoic acid

Catalog	Name
JAC29431-01	2- (Dimethylamino) pentanoic acid
T124502-01	2- (Dimethylamino) ethanesulfonic acid
sc-298157	2- (Dimethylamino) phenylboronic acid
MBS5790006	2-(Dimethylamino)ethanesulfonic acid
RG-D090554-01	2- (Dimethylamino) Nicotinic Acid
TRC-D583660-250MG	2-(Dimethylamino)benzenesulfonic Acid
sc-340264	2- (dimethylamino) isonicotinic acid
abx185623-01	2-(Dimethylamino)phenylboronic acid
sc-282737	2- (dimethylamino) butanoic acid
sc-282739	2- (dimethylamino) propanoic acid