3273-68-5

Name 1H-BENZIMIDAZOLE-1-BUTANOIC ACID, 2,3-DIHYDRO-2-OXO
CAS 3273-68-5
EINECS(EC#) 690-971-2
Molecular Formula C11H12N2O3
MDL Number MFCD06656423
Molecular Weight 220.22
MOL File 3273-68-5.mol

Chemical Properties

Melting point  175-176℃
Boiling point  422.74℃[at 101 325 Pa]
density  1.316
storage temp.  Refrigerator
solubility  DMSO (Slightly), Ethyl Acetate (Very Slightly, Heated), Methanol (Slightly)
form  Solid
pka 4.75±0.10(Predicted)
color  White to Pale Brown
InChI InChI=1S/C11H12N2O3/c14-10(15)6-3-7-13-9-5-2-1-4-8(9)12-11(13)16/h1-2,4-5H,3,6-7H2,(H,12,16)(H,14,15)
InChIKey PTNUQSFEJXMNOQ-UHFFFAOYSA-N
SMILES C1(=O)N(CCCC(O)=O)C2=CC=CC=C2N1
LogP 1.27

Safety Data

Symbol(GHS)  Corrosion (GHS05)Flame (GHS02)
GHS05,GHS02
Signal word  Danger
Hazard statements  H314-H225
Precautionary statements  P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405
REACH Registrations Active
HazardClass  IRRITANT

Hazard Information

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