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Home Carboxys 3,5-Dimethyl-1h-pyrrole-2,4-dicarboxylic acid 2-tert-butyl ester 4-ethyl ester

3,5-Dimethyl-1h-pyrrole-2,4-dicarboxylic acid 2-tert-butyl ester 4-ethyl ester

CAS No.:
86770-31-2
Catalog Number:
AG003A97
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$27
- +
5g
98%
In Stock USA
United States
$75
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$232
- +
100g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG003A97
Chemical Name:
3,5-Dimethyl-1h-pyrrole-2,4-dicarboxylic acid 2-tert-butyl ester 4-ethyl ester
CAS Number:
86770-31-2
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
MDL Number:
MFCD02179394
IUPAC Name:
2-O-tert-butyl 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
InChI:
InChI=1S/C14H21NO4/c1-7-18-12(16)10-8(2)11(15-9(10)3)13(17)19-14(4,5)6/h15H,7H2,1-6H3
InChI Key:
CJXJFSNESZDOGK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(C)[nH]c(c1C)C(=O)OC(C)(C)C
EC Number:
617-915-1
Properties
Complexity:
348  
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:
6  
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties