Introduction:Basic information about CAS 442847-69-0|(5R,6S)-4-NITROBENZYL 3-((2-AMINOETHYL)THIO)-6-((R)-1-HYDROXYETHYL)-7-OXO-1-A, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (5R,6S)-4-NITROBENZYL 3-((2-AMINOETHYL)THIO)-6-((R)-1-HYDROXYETHYL)-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLATE HYDROCHLORIDE |
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| CAS Number | 442847-69-0 | Molecular Weight | 442.89400 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C18H21ClN3O6S- | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 3-(2-aminoethylsulfanyl)-6-(1-hydroxyethyl)-4-[(4-nitrophenyl)methyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate,hydrochloride |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C18H21ClN3O6S- |
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| Molecular Weight | 442.89400 |
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| Exact Mass | 442.08400 |
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| PSA | 177.81000 |
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| LogP | 1.59170 |
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| InChIKey | BCBCYQNULZNYOZ-GCDFSTCFSA-N |
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| SMILES | CC(O)C1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)=C(SCCN)CC12.Cl |
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Synonyms
| 3-(2-azanylethylsulfanyl)-6-(1-hydroxyethyl)-4-[(4-nitrophenyl)methyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate hydrochloride |
| (5R,6S)-4-Nitrobenzyl-3-[(2-aminoethyl)thio]-6-[(1R)-1-hydroxyethyl]-1-azabicyclo[3.2.0]hept-2-ene-7-one-2-carboxylate hydrochloride |
| 3-(2-aminoethylthio)-6-(1-hydroxyethyl)-4-[(4-nitrophenyl)methyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate hydrochloride |