Home Carboxys Ethyl 3-amino-4-cyano-5-methyl-1H-pyrrole-2-carboxylate

Ethyl 3-amino-4-cyano-5-methyl-1H-pyrrole-2-carboxylate

CAS No.:
74455-30-4
Catalog Number:
AG005XOD
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG005XOD
Chemical Name:
Ethyl 3-amino-4-cyano-5-methyl-1H-pyrrole-2-carboxylate
CAS Number:
74455-30-4
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
MDL Number:
MFCD10699680
IUPAC Name:
ethyl 3-amino-4-cyano-5-methyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C9H11N3O2/c1-3-14-9(13)8-7(11)6(4-10)5(2)12-8/h12H,3,11H2,1-2H3
InChI Key:
UBEYZIPJHWUTOV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]c(c(c1N)C#N)C
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties