Home Carboxys ethyl 4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate

ethyl 4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate

CAS No.:
151982-52-4
Catalog Number:
AG01C2MA
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
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Product Description
Catalog Number:
AG01C2MA
Chemical Name:
ethyl 4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate
CAS Number:
151982-52-4
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
MDL Number:
MFCD24594519
IUPAC Name:
ethyl 4-(2-methylpropanoyl)-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C11H15NO3/c1-4-15-11(14)9-5-8(6-12-9)10(13)7(2)3/h5-7,12H,4H2,1-3H3
InChI Key:
GYEIUHGROQOMQK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]cc(c1)C(=O)C(C)C
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties