71607-31-3

Name DI-P-TOLUOYL-D-TARTARIC ACID MONOHYDRATE
CAS 71607-31-3
EINECS(EC#) 251-132-2
Molecular Formula C20H20O9
MDL Number MFCD00149567
Molecular Weight 404.37
MOL File 71607-31-3.mol
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Chemical Properties

Melting point  163-165 °C(lit.)
alpha  142 º (C=1 IN MEOH)
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
form  Solid
color  White to Off-White
Optical Rotation [α]20/D +142°, c = 1 in methanol
InChI InChI=1/C20H18O8.H2O/c1-11-3-7-13(8-4-11)19(25)27-15(17(21)22)16(18(23)24)28-20(26)14-9-5-12(2)6-10-14;/h3-10,15-16H,1-2H3,(H,21,22)(H,23,24);1H2/t15-,16-;/s3
InChIKey FOTRUJUPLHRVNU-MOGJOVFKSA-N
SMILES C(O)(=O)[C@H]([C@@H](C(O)=O)OC(=O)C1=CC=C(C)C=C1)OC(=O)C1=CC=C(C)C=C1.[H]O[H] |&1:3,4,r|
CAS DataBase Reference 71607-31-3(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Safety Statements 
WGK Germany  3
HS Code  29181990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2

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