56009-23-5
1-ETHYL-1-METHYL-2-PROPYNYL 4-NITROBENZOATE
Name
1-ETHYL-1-METHYL-2-PROPYNYL 4-NITROBENZOATE
Formula
C13 H13 N O4
MolWeight
247.249
1Identification
【Name】
1-ETHYL-1-METHYL-2-PROPYNYL 4-NITROBENZOATE
【CAS】
【MDL】
MFCD18430897
【English Synonyms】
【Formula】
C13 H13 N O4
【MolWeight】
247.249
【Inchi】
InChI=1S/C13H13NO4/c1-4-13(3,5-2)18-12(15)10-6-8-11(9-7-10)14(16)17/h1,6-9H,5H2,2-3H3
【InChIKey】
InChIKey=BMYYHJWJYBIWKL-UHFFFAOYSA-N
【SMILES】
CCC(C)(C#C)OC(=O)c1ccc(cc1)[N+](=O)[O-]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-ETHYL-1-METHYL-2-PROPYNYL 4-NITROBENZOATE.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:PH007274 25MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
IcanChemical Ltd.
Catalog No:ICC-034927 1G
Country/Region:China
Business Type:Trading Company
http://www.shrschemical.com
More 56009-23-5 Suppliers>>
Catalog No:PH007274 25MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
IcanChemical Ltd.
Catalog No:ICC-034927 1G
Country/Region:China
Business Type:Trading Company
http://www.shrschemical.com
More 56009-23-5 Suppliers>>