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[(1R,2S)-2-[benzyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-phenylpropyl] propanoate

[(1R,2S)-2-[benzyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-phenylpropyl] propanoate structure

CAS No:
187324-66-9
Formula:
C28H33NO4S
Chemical Name:
[(1R,2S)-2-[benzyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-phenylpropyl] propanoate
Synonyms:
(1R,2S)-N-Benzyl-N-(mesitylenesulfonyl)-O-propionylnorephedrine; P1371; (1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Propionate; Propionic Acid (1R,2S)-2-[N-Benzyl-N-(mesitylenesulfonyl)amino]-1-phenylpropyl Ester;

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[(1R,2S)-2-[benzyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-phenylpropyl] propanoate Basic Attributes

Molecular Weight：

479.63100

Exact Mass：

479.21302971

DSSTox ID：

DTXSID60458200

Characteristics

PSA：

72.06000

XLogP3：

6.96650

Density：

1.163g/cm3

Melting Point：

149ºC

Boiling Point：

615.2ºC at 760 mmHg

Flash Point：

325.8ºC

Refractive Index：

1.578

Vapor Pressure：

4.57E-15mmHg at 25°C

Computed Properties

Molecular Weight:479.6
XLogP3:6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:479.21302971
Monoisotopic Mass:479.21302971
Topological Polar Surface Area:72.1
Heavy Atom Count:34
Complexity:724
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [(1R,2S)-2-[benzyl-(2,4,6-trimethylphenyl)sulfonylamino]-1-phenylpropyl] propanoate

Basic Attributes
Characteristics
Computed Properties
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