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Home Carboxys 2-Methyl-1H-pyrrole-3-carboxylic acid ethyl ester

2-Methyl-1H-pyrrole-3-carboxylic acid ethyl ester

CAS No.:
936-12-9
Catalog Number:
AG003Q4W
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$18
- +
5g
95%
In Stock USA
United States
$43
- +
10g
95%
In Stock USA
United States
$84
- +
25g
95%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$619
- +
Product Description
Catalog Number:
AG003Q4W
Chemical Name:
2-Methyl-1H-pyrrole-3-carboxylic acid ethyl ester
CAS Number:
936-12-9
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD00101795
IUPAC Name:
ethyl 2-methyl-1H-pyrrole-3-carboxylate
InChI:
InChI=1S/C8H11NO2/c1-3-11-8(10)7-4-5-9-6(7)2/h4-5,9H,3H2,1-2H3
InChI Key:
DJDPDVJJTIGJTE-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc[nH]c1C
NSC Number:
81361
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.079g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties