Home Other Building Blocks ethyl 3-(1-methyl-1H-pyrrol-2-yl)-3-oxopropanoate

ethyl 3-(1-methyl-1H-pyrrol-2-yl)-3-oxopropanoate

CAS No.:
77640-10-9
Catalog Number:
AG01C3SD
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
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Product Description
Catalog Number:
AG01C3SD
Chemical Name:
ethyl 3-(1-methyl-1H-pyrrol-2-yl)-3-oxopropanoate
CAS Number:
77640-10-9
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD21337240
IUPAC Name:
ethyl 3-(1-methylpyrrol-2-yl)-3-oxopropanoate
InChI:
InChI=1S/C10H13NO3/c1-3-14-10(13)7-9(12)8-5-4-6-11(8)2/h4-6H,3,7H2,1-2H3
InChI Key:
VABCJCIFLKGBSR-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1cccn1C
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties