57100-28-4
P-HYDROXY-BETA-[CARBOXYMETHYL]-CINNAMIC ACID
NameP-HYDROXY-BETA-[CARBOXYMETHYL]-CINNAMIC ACID
1Identification
【Name】
P-HYDROXY-BETA-[CARBOXYMETHYL]-CINNAMIC ACID
【CAS】
【MDL】
MFCD09754458
【English Synonyms】
【Formula】
C11 H10 O5
【MolWeight】
222.195
【Inchi】
InChI=1S/C11H10O5/c12-9-3-1-7(2-4-9)8(5-10(13)14)6-11(15)16/h1-5,12H,6H2,(H,13,14)(H,15,16)/b8-5-
【InChIKey】
InChIKey=VOWYJJSQRYBVGK-YVMONPNESA-N
【SMILES】
c1cc(ccc1/C(=C\C(=O)O)/CC(=O)O)O
【MOL File】
P-HYDROXY-BETA-[CARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
P-HYDROXY-BETA-[CARBOXYMETHYL]-CINNAMIC ACID.cml