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Home Carbonyls Ethyl 2,4-dimethyl-5-(ethoxycarbonyl)-3-pyrrolepropionate

Ethyl 2,4-dimethyl-5-(ethoxycarbonyl)-3-pyrrolepropionate

CAS No.:
54278-10-3
Catalog Number:
AG003Q2D
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$80
- +
5g
95%
In Stock USA
United States
$383
- +
Product Description
Catalog Number:
AG003Q2D
Chemical Name:
Ethyl 2,4-dimethyl-5-(ethoxycarbonyl)-3-pyrrolepropionate
CAS Number:
54278-10-3
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
MDL Number:
MFCD00010644
IUPAC Name:
ethyl 4-(3-ethoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C14H21NO4/c1-5-18-12(16)8-7-11-9(3)13(15-10(11)4)14(17)19-6-2/h15H,5-8H2,1-4H3
InChI Key:
ZYNJVGCLOFPWFZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCc1c(C)[nH]c(c1C)C(=O)OCC
NSC Number:
157290
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.147g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.325g/mol
Monoisotopic Mass:
267.147g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties