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4-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Benzonitrile
[CAS# 253129-07-6]

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CAS#: 253129-07-6
Product: 4-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Benzonitrile
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Identification
Name 4-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Benzonitrile
Molecular Structure CAS#: 253129-07-6, 4-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Benzonitrile
Molecular Formula C12H14N2O3
Molecular Weight 234.25
CAS Registry Number 253129-07-6
SMILES N#Cc1ccc(cc1)[C@@H]2N[C@H](CO)[C@@H](O)[C@H]2O
InChI 1S/C12H14N2O3/c13-5-7-1-3-8(4-2-7)10-12(17)11(16)9(6-15)14-10/h1-4,9-12,14-17H,6H2/t9-,10+,11-,12+/m1/s1
InChIKey YXHNAPRFHIQZRC-KXNHARMFSA-N
Properties
Density 1.411g/cm3 (Cal.)
Boiling point 489.875°C at 760 mmHg (Cal.)
Flash point 250.068°C (Cal.)
Refractive index 1.65 (Cal.)
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List of Reports Available for 4-[(2S,3S,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Benzonitrile
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