Acetic acid, [[2-(diethylamino)ethyl]thio]-,(3aS,4R,5S,6S,8R,9S,9aR,10R)-6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-ylester, (2E)-2-butenedioate (1:1) (salt)


Chemical Name: Acetic acid, [[2-(diethylamino)ethyl]thio]-,(3aS,4R,5S,6S,8R,9S,9aR,10R)-6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-ylester, (2E)-2-butenedioate (1:1) (salt)
CAS Number: 55297-96-6
Product Number: AG01CCMN(AGN-PC-0SJ0IS)
Synonyms:
MDL No:
Molecular Formula: C32H51NO8S
Molecular Weight: 609.8142

Identification/Properties


Properties
MP:
139-141°C
BP:
563°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
609.819g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
12
Exact Mass:
609.334g/mol
Monoisotopic Mass:
609.334g/mol
Topological Polar Surface Area:
167A^2
Heavy Atom Count:
42
Formal Charge:
0
Complexity:
889
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
8
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback