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131180-63-7

131180-63-7 structural image
Product Name: (S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
Formula: C21H27NO
Synonyms: (S)-(−)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H400:Hazardous to the aquatic environment, acute hazard
Precautionary Statement Codes P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 309.4 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 309.209264485 g/mol
Monoisotopic Mass 309.209264485 g/mol
Topological Polar Surface Area 32.3 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 349
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes