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449797-42-6
1-(2-CHLOROPHENYL)-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-3-CARBOXYLIC ACID
Name
1-(2-CHLOROPHENYL)-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-3-CARBOXYLIC ACID
Formula
C18 H15 Cl N2 O2
MolWeight
326.781
1Identification
【Name】
1-(2-CHLOROPHENYL)-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00628369
【English Synonyms】
【Formula】
C18 H15 Cl N2 O2
【MolWeight】
326.781
【Inchi】
InChI=1S/C18H15ClN2O2/c19-13-7-3-1-6-11(13)16-17-12(9-15(21-16)18(22)23)10-5-2-4-8-14(10)20-17/h1-8,15-16,20-21H,9H2,(H,22,23)
【InChIKey】
InChIKey=JNLXAXOXLWSEML-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)c3c([nH]2)C(NC(C3)C(=O)O)c4ccccc4Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-CHLOROPHENYL)-2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-3-CARBOXYLIC ACID.cml
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Catalog No:R648752-10MG 10MG
Country/Region:United States
Business Type:Reagent Company
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Princeton BioMolecular Research, Inc.
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Zylexa Pharma Ltd.
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