CALPEPTIN

Melting point :60-75 °C
Boiling point :494.07°C (rough estimate)
Density :1.1667 (rough estimate)
refractive index :1.6800 (estimate)
storage temp. :-20°C
solubility :Soluble in DMSO at 15mg/ml
form :White to off-white solid
pka :11.14±0.46(Predicted)
color :white to beige
InChI :1S/C20H30N2O4/c1-4-5-11-17(13-23)21-19(24)18(12-15(2)3)22-20(25)26-14-16-9-7-6-8-10-16/h6-10,13,15,17-18H,4-5,11-12,14H2,1-3H3,(H,21,24)(H,22,25)/t17-,18-/m0/s1
InChIKey :PGGUOGKHUUUWAF-ROUUACIJSA-N
SMILES :C(OCC1=CC=CC=C1)(=O)N[C@H](C(N[C@H](C=O)CCCC)=O)CC(C)C
CAS DataBase Reference :117591-20-5(CAS DataBase Reference)

Symbol(GHS):
Signal word:	Warning
Hazard statements:	Code Hazard statements Hazard class Category Signal word Pictogram P-Codes H302 Harmful if swallowed Acute toxicity,oral Category 4 Warning P264, P270, P301+P312, P330, P501 H315 Causes skin irritation Skin corrosion/irritation Category 2 Warning P264, P280, P302+P352, P321,P332+P313, P362 H319 Causes serious eye irritation Serious eye damage/eye irritation Category 2A Warning P264, P280, P305+P351+P338,P337+P313P H335 May cause respiratory irritation Specific target organ toxicity, single exposure;Respiratory tract irritation Category 3 Warning
Precautionary statements:	P261 Avoid breathing dust/fume/gas/mist/vapours/spray. P280 Wear protective gloves/protective clothing/eye protection/face protection. P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352 IF ON SKIN: wash with plenty of soap and water. P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.