(2E)-but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine

Compound number:
MolPort-023-276-235
CAS number: 169675-09-6
IUPAC:
(2E)-but-2-enedioic acid; (2S)-1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine
IUPAC traditional:
(2S)-1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine; fumaric acid
SMILES:
OC(=O)\C=C\C(O)=O.C[C@H](N)Cn1ccc2cc(F)c(Cl)cc12
InChI key:
CEPHEXXZGQBXGT-XZTIXWOLSA-N
Molecular formula:
C15H16ClFN2O4
Molecular weight: 342.75
Solubility: not available

Marketplace Offers

S&H to USA: 60.00 USD
S&H to World: 60.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: > 98%
Last updated: today In warehouse: Unverified
Pack size Ships out Price Qty
10 mg February 4, 2020 140.42 USD
ADD TO CART
50 mg February 4, 2020 492.06 USD
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S&H to USA: 40.00 USD
S&H to World: 60.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 2 business days Purity: 99.0
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
10 mg January 30, 2020 135.70 USD
ADD TO CART
50 mg January 30, 2020 489.70 USD
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More Information

Compound Identifiers
Compound number: MolPort-023-276-235
CAS number: 169675-09-6

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000012841339
MFCD06798313
1H-Indole-1-ethanamine, 6-chloro-5-fluoro-a-methyl-, (aS)-, (2E)-2-butenedioate (1:1)
RO 60-0175
Ro 60-0175 fumarate
(S)-1-(6-Chloro-5-fluoro-1H-indol-1-yl)propan-2-amine fumarate
(S)-2-(6-Chloro-5-fluoro-indol-1-yl)-1-methyl-ethylamine fumarate

InChI
InChI: 1S/C11H12ClFN2.C4H4O4/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15;5-3(6)1-2-4(7)8/h2-5,7H,6,14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t7-;/m0./s1
InChI key: CEPHEXXZGQBXGT-XZTIXWOLSA-N

Calculated Properties
Molecular formula: C15H16ClFN2O4
Molecular weight: 342.75

Other

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2020 MolPort, v3.34, release date 28-01-2020 13:00 (+0200). All rights reserved.
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