Home Carboxys 1H-Pyrrole-2-carboxylic acid,4-ethyl-3-methyl-,ethyl ester

1H-Pyrrole-2-carboxylic acid,4-ethyl-3-methyl-,ethyl ester

CAS No.:
4391-98-4
Catalog Number:
AG00DY2Q
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
90%
In Stock USA
United States
$210
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Product Description
Catalog Number:
AG00DY2Q
Chemical Name:
1H-Pyrrole-2-carboxylic acid,4-ethyl-3-methyl-,ethyl ester
CAS Number:
4391-98-4
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD20661223
IUPAC Name:
ethyl 4-ethyl-3-methyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C10H15NO2/c1-4-8-6-11-9(7(8)3)10(12)13-5-2/h6,11H,4-5H2,1-3H3
InChI Key:
VRVOLGXNSYCRON-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]cc(c1C)CC
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