1-Phenanthrenecarboxylic acid,1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,sodium salt, (1R,4aR,4bR,10aR)-


Chemical Name: 1-Phenanthrenecarboxylic acid,1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,sodium salt, (1R,4aR,4bR,10aR)-
CAS Number: 14351-66-7
Product Number: AG003NM0(AGN-PC-0PU4YG)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties


Properties
BP:
439.5°C at 760 mmHg
Computed Properties
Molecular Weight:
324.44g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
324.207g/mol
Monoisotopic Mass:
324.207g/mol
Topological Polar Surface Area:
40.1A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
548
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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