2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid

C₁₈H₁₉NO₄CAS 5809-23-4313.35 g/mol

Open in Covalent MOL file

Alcohol Carboxylic Acid Ketone Tertiary Amine

Properties

Molecular formula: C₁₈H₁₉NO₄
Molar mass: 313.35 g/mol
Exact mass: 313.1314 Da
Melting point: 205–207 °C
logP: 3.17Crippen estimate
Polar surface area: 77.8 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 6

Identifiers

CAS number

5809-23-4

SMILES

CCN(CC)c1ccc(C(=O)c2ccccc2C(=O)O)c(O)c1

InChIKey

FQNKTJPBXAZUGC-UHFFFAOYSA-N

InChI

InChI=1S/C18H19NO4/c1-3-19(4-2)12-9-10-15(16(20)11-12)17(21)13-7-5-6-8-14(13)18(22)23/h5-11,20H,3-4H2,1-2H3,(H,22,23)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

14 names · show all

Benzoic acid, 2-[4-(diethylamino)-2-hydroxybenzoyl]-
Benzoic acid, o-[4-(diethylamino)salicyloyl]-
o-[2-Hydroxy-4-(diethylamino)benzoyl]benzoic acid
2′-Carboxy-4-(diethylamino)-2-hydroxybenzophenone
4-(Diethylamino)-2-hydroxy-2′-carboxybenzophenone
o-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid
1-(2-Carboxybenzoyl)-4-(diethylamino)-2-hydroxybenzene
2-[2-Hydroxy-4-(diethylamino)benzoyl]benzoic acid
4-(2-Carboxybenzoyl)-N,N-diethyl-3-hydroxyaniline
2-Hydroxy-4-(diethylamino)-2′-carboxybenzophenone
4-N,N-Diethylamino-2-hydroxy-2′-carboxybenzophenone
NSC 625797
2-Carboxyl-4′-diethylamino-2′-hydroxybenzophenone
2-(4-N,N-Diethylamino-2-hydroxybenzoyl)-benzoic acid

Work with 2-[4-(Diethylamino)-2-hydroxybenzoyl]benzoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Kresoxim-methyl143390-89-0 (+)-Norisoboldine23599-69-1 N-Benzoyl-L-tyrosine ethyl ester3483-82-7 (+)-Laurolitsine5890-18-6 N-trans-Feruloyltyramine66648-43-9

Elsewhere

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