Home Carboxys Ethyl 5-formyl-1h-pyrrole-2-carboxylate

Ethyl 5-formyl-1h-pyrrole-2-carboxylate

CAS No.:
7126-50-3
Catalog Number:
AG005VTT
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$363
- +
Product Description
Catalog Number:
AG005VTT
Chemical Name:
Ethyl 5-formyl-1h-pyrrole-2-carboxylate
CAS Number:
7126-50-3
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD00159462
IUPAC Name:
ethyl 5-formyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C8H9NO3/c1-2-12-8(11)7-4-3-6(5-10)9-7/h3-5,9H,2H2,1H3
InChI Key:
HTPFMOGFQKDFHX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc([nH]1)C=O
NSC Number:
272667
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties