Butyl anthranilate

C11H15NO2CAS 7756-96-9193.25 g/mol

Open in Covalent MOL file
OOH2N
EsterPrimary amine

Properties

Molecular formula
C11H15NO2
Molar mass
193.25 g/mol
Exact mass
193.1103 Da
Density
1.067–1.073 g/mL
Melting point
below 0 °C
Boiling point
182 °C
Water solubility
insoluble
logP
2.23Crippen estimate
Polar surface area
52.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 139 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
7756-96-9
SMILES
CCCCOC(=O)c1ccccc1N
InChIKey
HUIYGGQINIVDNW-UHFFFAOYSA-N
InChI
InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7H,2-3,8,12H2,1H3

Weigh it out

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

Names and synonyms

6 names
  • Benzoic acid, 2-amino-, butyl ester
  • Anthranilic acid, butyl ester
  • 2-Aminobenzoic acid butyl ester
  • Butyl o-aminobenzoate
  • NSC 406509
  • Butyl 2-aminobenzoate

Work with Butyl anthranilate

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dibutyl phthalate84-74-276 % similar Dipentyl phthalate131-18-069 % similar Di-n-octyl phthalate117-84-068 % similar Diheptyl phthalate3648-21-368 % similar Dihexyl phthalate84-75-368 % similar Dinonyl 1,2-benzenedicarboxylate84-76-468 % similar Didecyl phthalate84-77-568 % similar Ethyl 2-aminobenzoate87-25-268 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl 4-(dimethylamino)benzoate10287-53-3 β-Amino-4-ethylbenzenepropanoic acid117391-52-3 (3R,4R)-(-)-1-Benzyl-3,4-pyrrolidindiol163439-82-5 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline1745-07-9 4-(Diethylamino)-2-hydroxybenzaldehyde17754-90-4 tert-Butyl 4-aminobenzoate18144-47-3 N,N-Diethyl-2-hydroxybenzamide19311-91-2 1-Methylethyl 3-amino-4-methylbenzoate21447-47-2

Elsewhere

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