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Lactoyl-CoA
Venetoclax
Cryptolepine
10001-82-8
Cefepime Impurity A
chem960
66586-93-4
Phenol, tetramethyl- | 66586-93-4
Product name:Phenol, tetramethyl-
CAS No:
66586-93-4
MF:C38H72O6
MW:624.97468
CID:396114
PubChem ID:
227233
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Basic Information
Names and Identifiers
Phenol, tetramethyl-
4,7-di(decanoyloxy)octyl decanoate
TETRAMETHYL-PHENOL
DTXSID00280789
NSC-18577
NSC18577
octane-1,4,7-triyl tridecanoate
66586-93-4
5453-36-1
การขยายตัว
InChIKey:YUQPLGDFRZAIPX-UHFFFAOYSA-N
Inchi:InChI=1S/C38H72O6/c1-5-8-11-14-17-20-23-28-36(39)42-33-26-27-35(44-38(41)30-25-22-19-16-13-10-7-3)32-31-34(4)43-37(40)29-24-21-18-15-12-9-6-2/h34-35H,5-33H2,1-4H3
SMILES:CCCCCCCCCC(=O)OCCCC(CCC(C)OC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC
Chemical and Physical Properties
Computed Properties
Exact Mass: 150.10452
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 36
Monoisotopic Mass: 624.53289001g/mol
Heavy Atom Count: 44
Complexity: 664
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 2
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
XLogP3: 14.1
Topological Polar Surface Area: 78.9Ų
Experimental Properties
PSA: 20.23
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