71839-12-8

Name 4-(Butylamino)-benzoic acid, methyl ester
CAS 71839-12-8
Molecular Formula C12H17NO2
MDL Number MFCD11177285
Molecular Weight 207.27
MOL File 71839-12-8.mol
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Chemical Properties

Melting point  104℃
Boiling point  323.3±25.0 °C(Predicted)
density  1.055
storage temp.  -20°C Freezer
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 2.61±0.32(Predicted)
color  Pale Yellow to Pale Beige
Major Application pharmaceutical (small molecule)
InChI 1S/C12H17NO2/c1-3-4-9-13-11-7-5-10(6-8-11)12(14)15-2/h5-8,13H,3-4,9H2,1-2H3
InChIKey IHRPJNDVWBJCEH-UHFFFAOYSA-N
SMILES N(CCCC)c1ccc(cc1)C(=O)OC

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
REACH Registrations Active
HS Code  2922493800
Storage Class 11 - Combustible Solids

Hazard Information

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