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74455-30-4
ETHYL 3-AMINO-4-CYANO-5-METHYL-1H-PYRROLE-2-CARBOXYLATE
Name
ETHYL 3-AMINO-4-CYANO-5-METHYL-1H-PYRROLE-2-CARBOXYLATE
Formula
C9 H11 N3 O2
MolWeight
193.205
1Identification
【Name】
ETHYL 3-AMINO-4-CYANO-5-METHYL-1H-PYRROLE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD10699680
【English Synonyms】
【Formula】
C9 H11 N3 O2
【MolWeight】
193.205
【Inchi】
InChI=1S/C9H11N3O2/c1-3-14-9(13)8-7(11)6(4-10)5(2)12-8/h12H,3,11H2,1-2H3
【InChIKey】
InChIKey=UBEYZIPJHWUTOV-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(c(c([nH]1)C)C#N)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
Combi-Blocks Inc. :ETHYL 3-AMINO-4-CYANO-5-METHYL-1H-PYRROLE-2-CARBOXYLATE
4CML File
ETHYL 3-AMINO-4-CYANO-5-METHYL-1H-PYRROLE-2-CARBOXYLATE.cml
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