Phenol, 2-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-methyl-,(2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)


Chemical Name: Phenol, 2-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-methyl-,(2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)
CAS Number: 124937-52-6
Product Number: AG00ILQB(AGN-PC-0PHX0R)
Synonyms:
MDL No:
Molecular Formula: C26H37NO7
Molecular Weight: 475.5745

Identification/Properties


Computed Properties
Molecular Weight:
475.582g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
10
Exact Mass:
475.257g/mol
Monoisotopic Mass:
475.257g/mol
Topological Polar Surface Area:
139A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
474
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



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