Home Carboxys 4-Methyl-2-pyrrolecarboxylic acid ethyl ester

4-Methyl-2-pyrrolecarboxylic acid ethyl ester

CAS No.:
40611-85-6
Catalog Number:
AG003QBD
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$253
- +
5g
95%
In Stock USA
United States
$843
- +
Product Description
Catalog Number:
AG003QBD
Chemical Name:
4-Methyl-2-pyrrolecarboxylic acid ethyl ester
CAS Number:
40611-85-6
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD00191668
IUPAC Name:
ethyl 4-methyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C8H11NO2/c1-3-11-8(10)7-4-6(2)5-9-7/h4-5,9H,3H2,1-2H3
InChI Key:
RWFKYBVNHRKZSN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]cc(c1)C
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties