(1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile; oxalic acid



Compound number:
MolPort-003-666-613
CAS number: 128196-01-0; 219861-08-2; 219861-53-7
IUPAC:
(1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile; oxalic acid
IUPAC traditional:
escitalopram; oxalic acid
SMILES:
OC(=O)C(O)=O.CN(C)CCC[[email protected]]1(OCc2cc(ccc12)C#N)c1ccc(F)cc1 |r|
InChI key:
KTGRHKOEFSJQNS-BDQAORGHSA-N
Molecular formula:
C22H23FN2O5
Molecular weight: 414.433
Solubility: not available

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Catalog: Screening compound Ships out: 3 business days Purity: 99.93%
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25 mg May 14, 2021 50.00 USD
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50 mg May 14, 2021 68.00 USD
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100 mg May 14, 2021 93.00 USD
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Catalog: Screening compound Ships out: 2 business days Purity: 99.00
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10 mg May 13, 2021 64.50 USD
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50 mg May 13, 2021 116.10 USD
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Catalog: Screening compound Ships out: 15 business days Purity: n/a
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10 mg June 1, 2021 70.95 USD
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50 mg June 1, 2021 99.33 USD
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100 mg June 1, 2021 112.23 USD
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Catalog: Screening compound Ships out: 10 business days Purity: 97%
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5 mg May 25, 2021 48.00 USD
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10 mg May 25, 2021 58.00 USD
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Catalog: Screening compound Ships out: 15 business days Purity: > 99%
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10 mg June 1, 2021 107.07 USD
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50 mg June 1, 2021 398.61 USD
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Catalog: Building blocks Ships out: 9 business days Purity: >98%
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10 mg May 24, 2021 60.00 USD
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50 mg May 24, 2021 84.00 USD
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100 mg May 24, 2021 96.00 USD
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Catalog: Building blocks Ships out: 3 business days Purity: 98.00%
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250 mg May 14, 2021 72.00 USD
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1 g May 14, 2021 218.00 USD
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Catalog: Building blocks Ships out: 11 business days Purity: 98%
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0.25 g May 26, 2021 15.00 USD
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1 g May 26, 2021 23.00 USD
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Catalog: Building blocks Ships out: 5 business days Purity: 99%(HPLC)
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25 mg May 18, 2021 42.00 USD
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100 mg May 18, 2021 63.00 USD
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1 g May 18, 2021 390.00 USD
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Catalog: Building blocks Ships out: 8 business days Purity: 99%(HPLC)
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25 mg May 21, 2021 50.00 USD
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100 mg May 21, 2021 68.00 USD
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1 g May 21, 2021 336.00 USD
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Catalog: Building blocks Ships out: 11 business days Purity: 99%(HPLC)
Last updated: last week In warehouse: 1000.00 mg
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25 mg May 26, 2021 73.00 USD
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0.1 g May 26, 2021 95.00 USD
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1 g May 26, 2021 424.00 USD
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Catalog: Building blocks Ships out: 3 business days Purity: > 99%
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10 mg May 14, 2021 178.01 USD
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More Information

Compound Identifiers
Compound number: MolPort-003-666-613
CAS number: 128196-01-0; 219861-08-2; 219861-53-7

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000003800706
(1S)-1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarbonitrile Ethanedioate
(R)-Citalopram Oxalate
(S)-(+)Citalopram Oxalate
(S)-1-(3-(Dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile oxalate
(S)-Citalopram Oxalate
1-(3-Dimethylamino-propyl)-1-(4-fluoro-phenyl)-1,3-dihydro-isobenzofuran-5-carbonitrile
Cipralex
Citalopram Oxalate
Escitalopram
Escitalopram 
compound with oxalic acid
escitalopram oxalate
MFCD06407826

InChI
InChI: 1S/C20H21FN2O.C2H2O4/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20;3-1(4)2(5)6/h4-9,12H,3,10-11,14H2,1-2H3;(H,3,4)(H,5,6)/t20-;/m0./s1
InChI key: KTGRHKOEFSJQNS-BDQAORGHSA-N

Calculated Properties
Molecular formula: C22H23FN2O5
Molecular weight: 414.433

Other

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