69-46-5
CALCIUM ASPIRIN
Name
CALCIUM ASPIRIN
Formula
C18 H14 Ca O8
MolWeight
398.379
1Identification
【Name】
CALCIUM ASPIRIN
【CAS】
【MDL】
MFCD01684536
【English Synonyms】
【Formula】
C18 H14 Ca O8
【MolWeight】
398.379
【Inchi】
InChI=1S/2C9H8O4.Ca/c2*1-6(10)13-8-5-3-2-4-7(8)9(11)12;/h2*2-5H,1H3,(H,11,12);/q;;+2/p-2
【InChIKey】
InChIKey=KRALOLGXHLZTCW-UHFFFAOYSA-L
【SMILES】
CC(=O)Oc1ccccc1C(=O)O[Ca]OC(=O)c2ccccc2OC(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
CALCIUM ASPIRIN.cml
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ACC Corporation
Catalog No:API0013513 5MG
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Beta Pharma Scientific, Inc.
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