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Alvimopan

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Alvimopan / CAS : 156053-89-3

Appearance White solid UN 3077 9 / PGIII
HS 2933399099 DG Class 0
Synonyms Alvimopan Anhydrous; Anhydrous Alvimopan; 2-[[(2S)-2-Benzyl-3-[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl]Propanoyl]Amino]Acetic acid; 2-((S)-2-Benzyl-3-((3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl)Propanamido)Acetic acid; Glycine, N-[(2S)-2-[[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethyl-1-Piperidinyl]Methyl]-1-oxo-3-Phenylpropyl]-; ((S)-2-Benzyl-3-((3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl)Propanoyl)Glycine; N-[(2S)-2-{[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl]Methyl}-3-Phenylpropanoyl]Glycine; Trans-3,4-Dimethyl-4-(3-Hydroxyphenyl) Piperidine; [[(S)-2-Benzyl-3-[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl]Propionyl]Amino]Acetic acid; 2-[(2S)-2-Benzyl-3-[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl]Propanamido]Acetic acid; 2-[[(2S)-2-[[(3R,4R)-4-(3-Hydroxyphenyl)-3,4-Dimethylpiperidin-1-yl]Methyl]-3-Phenylpropanoyl]Amino]Acetic acid; Alvimopan API
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Properties

Summary

Formula
C25H32N2O4
Molecular Mass
424.53300
Exact Mass
424.23600
PSA
89.87000
Logp
3.38020
IUPAC
2-[[(2S)-2-benzyl-3-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]propanoyl]amino]acetic acid
SMILES
C[C@H]1CN(CC[C@@]1(C)C2=CC(=CC=C2)O)C[C@H](CC3=CC=CC=C3)C(=O)NCC(=O)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
API & Intermediate > Digestive System Drugs

Chemical and Physical Properties

Melting Point
210-213ºC
Density
1.166g/cm3
Boiling Point
684.1ºC at 760mmHg
Flash Point
367.5ºC
Appearance
White solid

Export information

HS Code
2933399099
Export Rebate
13%
UN No.
3077 9 / PGIII
DG-Class
0

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