6786-83-0
SOLVENT BLUE 4
Name
SOLVENT BLUE 4
Formula
C33 H33 N3 O
MolWeight
487.644
1Identification
【Name】
SOLVENT BLUE 4
【CAS】
【MDL】
MFCD01940962
【English Synonyms】
【Formula】
C33 H33 N3 O
【MolWeight】
487.644
【Inchi】
InChI=1S/C33H33N3O/c1-35(2)27-18-14-24(15-19-27)33(37,25-16-20-28(21-17-25)36(3)4)31-22-23-32(30-13-9-8-12-29(30)31)34-26-10-6-5-7-11-26/h5-23,34,37H,1-4H3
【InChIKey】
InChIKey=WNDULEJVCPEASN-UHFFFAOYSA-N
【SMILES】
CN(C)c1ccc(cc1)C(c2ccc(cc2)N(C)C)(c3ccc(c4c3cccc4)Nc5ccccc5)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:7.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
SOLVENT BLUE 4.cml
Quick Release
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