52814-39-8
METESCULETOL
Name
METESCULETOL
Formula
C12 H10 O6
MolWeight
250.205
1Identification
【Name】
METESCULETOL
【CAS】
【MDL】
MFCD00868220
【English Synonyms】
【Formula】
C12 H10 O6
【MolWeight】
250.205
【Inchi】
InChI=1S/C12H10O6/c1-6-2-12(16)18-9-4-8(13)10(3-7(6)9)17-5-11(14)15/h2-4,13H,5H2,1H3,(H,14,15)
【InChIKey】
InChIKey=VVDLFTOOMLZFRO-UHFFFAOYSA-N
【SMILES】
Cc1cc(=O)oc2c1cc(c(c2)O)OCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METESCULETOL.cml
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Catalog No:ATM52814398 up to kgs
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Shanghai FWD Chemicals Limited
Catalog No:L4101
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Youchemicals Limited
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