53278-21-0
METHYL 2-[(2-OXOPROPYL)THIO]BENZOATE
Name
METHYL 2-[(2-OXOPROPYL)THIO]BENZOATE
Formula
C11 H12 O3 S
MolWeight
224.279
1Identification
【Name】
METHYL 2-[(2-OXOPROPYL)THIO]BENZOATE
【CAS】
【MDL】
MFCD00209313
【English Synonyms】
【Formula】
C11 H12 O3 S
【MolWeight】
224.279
【Inchi】
InChI=1S/C11H12O3S/c1-8(12)7-15-10-6-4-3-5-9(10)11(13)14-2/h3-6H,7H2,1-2H3
【InChIKey】
InChIKey=LXFGVTCWUZZPHD-UHFFFAOYSA-N
【SMILES】
CC(=O)CSc1ccccc1C(=O)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 2-[(2-OXOPROPYL)THIO]BENZOATE.cml
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