552-41-0

Name Paeonol
CAS 552-41-0
EINECS(EC#) 209-012-2
Molecular Formula C9H10O3
MDL Number MFCD00008730
Molecular Weight 166.17
MOL File 552-41-0.mol

Chemical Properties

Appearance white to beige crystalline powder
Melting point  48-50 °C(lit.)
Boiling point  154 °C / 20mmHg
density  1.3102
refractive index  1.5452 (estimate)
Fp  >230 °F
storage temp.  2-8°C
solubility  Acetonitrile (Slightly), Chloroform (Slightly), Methanol (Slightly)
form  Crystalline Powder
pka 9.79±0.10(Predicted)
color  White to beige
Odor Warm-aromatic odor
Odor Type pungent
BRN  1282794
Cosmetics Ingredients Functions SKIN CONDITIONING
ANTIOXIDANT
InChI InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
InChIKey UILPJVPSNHJFIK-UHFFFAOYSA-N
SMILES C(=O)(C1=CC=C(OC)C=C1O)C
LogP 1.980
CAS DataBase Reference 552-41-0(CAS DataBase Reference)
NIST Chemistry Reference Ethanone, 1-(2-hydroxy-4-methoxyphenyl)-(552-41-0)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302+H312+H332-H315-H319-H335
Precautionary statements  P261-P264-P280-P302+P352+P312-P304+P340+P312-P337+P313
Hazard Codes  Xn,Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
WGK Germany  3
RTECS  RT1215000
Hazard Note  Irritant
HS Code  29145000
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Toxicity
LD50 orl-mus: 3430 mg/kg YKKZAJ 89,1205,69

Hazard Information

Material Safety Data Sheet(MSDS)

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