Home Carboxys ethyl 3-ethyl-4-methyl-1H-pyrrole-2-carboxylate

ethyl 3-ethyl-4-methyl-1H-pyrrole-2-carboxylate

CAS No.:
4949-58-0
Catalog Number:
AG01DJ5L
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
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Product Description
Catalog Number:
AG01DJ5L
Chemical Name:
ethyl 3-ethyl-4-methyl-1H-pyrrole-2-carboxylate
CAS Number:
4949-58-0
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD06227772
IUPAC Name:
ethyl 3-ethyl-4-methyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C10H15NO2/c1-4-8-7(3)6-11-9(8)10(12)13-5-2/h6,11H,4-5H2,1-3H3
InChI Key:
IJIMBHGENKKALU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]cc(c1CC)C
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.11g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.235g/mol
Monoisotopic Mass:
181.11g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties