Home Carboxys Ethyl 1H-pyrrole-2-carboxylate

Ethyl 1H-pyrrole-2-carboxylate

CAS No.:
2199-43-1
Catalog Number:
AG003Q0R
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$57
- +
100g
98%
In Stock USA
United States
$150
- +
500g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG003Q0R
Chemical Name:
Ethyl 1H-pyrrole-2-carboxylate
CAS Number:
2199-43-1
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD00817049
IUPAC Name:
ethyl 1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C7H9NO2/c1-2-10-7(9)6-4-3-5-8-6/h3-5,8H,2H2,1H3
InChI Key:
PAEYAKGINDQUCT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc[nH]1
NSC Number:
81360
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Total synthesis of natural and unnatural lamellarins with saturated and unsaturated D-rings. The Journal of organic chemistry 20061208
Properties