28227-96-5
1-(3,4-DIHYDROXYPHENYL)-2-[(1-METHYLETHYL)AMINO]-1-PROPANONE
Name1-(3,4-DIHYDROXYPHENYL)-2-[(1-METHYLETHYL)AMINO]-1-PROPANONE
1Identification
【Name】
1-(3,4-DIHYDROXYPHENYL)-2-[(1-METHYLETHYL)AMINO]-1-PROPANONE
【CAS】
【MDL】
MFCD00867026
【English Synonyms】
【Formula】
C12 H17 N O3
【MolWeight】
223.27
【Inchi】
InChI=1S/C12H17NO3/c1-7(2)13-8(3)12(16)9-4-5-10(14)11(15)6-9/h4-8,13-15H,1-3H3
【InChIKey】
InChIKey=GPHUDPVNXDFRCO-UHFFFAOYSA-N
【SMILES】
CC(C)NC(C)C(=O)c1ccc(c(c1)O)O
【MOL File】
1-(3,4-DIHYDROXYPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3,4-DIHYDROXYPHENYL)-2-[(1-METHYLETHYL)AMINO]-1-PROPANONE.cml