856844-77-4
1-PIPERAZINECARBOXYLIC ACID, 4-(AMINOTHIOXOMETHYL)-, PHENYLMETHYL ESTER
Name
1-PIPERAZINECARBOXYLIC ACID, 4-(AMINOTHIOXOMETHYL)-, PHENYLMETHYL ESTER
Formula
C13 H17 N3 O2 S
MolWeight
279.362
1Identification
【Name】
1-PIPERAZINECARBOXYLIC ACID, 4-(AMINOTHIOXOMETHYL)-, PHENYLMETHYL ESTER
【CAS】
【MDL】
MFCD11977357
【English Synonyms】
【Formula】
C13 H17 N3 O2 S
【MolWeight】
279.362
【Inchi】
InChI=1S/C13H17N3O2S/c14-12(19)15-6-8-16(9-7-15)13(17)18-10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,14,19)
【InChIKey】
InChIKey=NXESMWCTIBCSIG-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COC(=O)N2CCN(CC2)C(=S)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-PIPERAZINECARBOXYLIC ACID, 4-(AMINOTHIOXOMETHYL)-, PHENYLMETHYL ESTER.cml
Quick Release
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Business Type:Trading Company
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Catalog No:ATM856844774 up to kgs
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Catalog No:Y01340
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