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Home Carboxys 5-(2-Chloro-acetyl)-2,4-dimethyl-1h-pyrrole-3-carboxylic acid ethyl ester

5-(2-Chloro-acetyl)-2,4-dimethyl-1h-pyrrole-3-carboxylic acid ethyl ester

CAS No.:
950-86-7
Catalog Number:
AG006PTU
Molecular Formula:
C11H14ClNO3
Molecular Weight:
243.6868
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$75
- +
250mg
98%
In Stock USA
United States
$125
- +
1g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG006PTU
Chemical Name:
5-(2-Chloro-acetyl)-2,4-dimethyl-1h-pyrrole-3-carboxylic acid ethyl ester
CAS Number:
950-86-7
Molecular Formula:
C11H14ClNO3
Molecular Weight:
243.6868
MDL Number:
MFCD01124420
IUPAC Name:
ethyl 5-(2-chloroacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
InChI:
InChI=1S/C11H14ClNO3/c1-4-16-11(15)9-6(2)10(8(14)5-12)13-7(9)3/h13H,4-5H2,1-3H3
InChI Key:
GBOIWLVLZHQEEK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(C)[nH]c(c1C)C(=O)CCl
NSC Number:
94992
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.066g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.687g/mol
Monoisotopic Mass:
243.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties