Home Carboxys Diethyl 1H-pyrrole-3,4-dicarboxylate

Diethyl 1H-pyrrole-3,4-dicarboxylate

CAS No.:
41969-71-5
Catalog Number:
AG00742S
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$191
- +
5g
1 week
United States
$775
- +
10g
1 week
United States
$1471
- +
Product Description
Catalog Number:
AG00742S
Chemical Name:
Diethyl 1H-pyrrole-3,4-dicarboxylate
CAS Number:
41969-71-5
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
MDL Number:
MFCD00192033
IUPAC Name:
diethyl 1H-pyrrole-3,4-dicarboxylate
InChI:
InChI=1S/C10H13NO4/c1-3-14-9(12)7-5-11-6-8(7)10(13)15-4-2/h5-6,11H,3-4H2,1-2H3
InChI Key:
QKXBVVVYILIRDO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c[nH]cc1C(=O)OCC
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties