Home Carboxys 1,2,5-Trimethyl-1H-pyrrole-3-carboxylic acid

1,2,5-Trimethyl-1H-pyrrole-3-carboxylic acid

CAS No.:
175276-50-3
Catalog Number:
AG0020QS
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG0020QS
Chemical Name:
1,2,5-Trimethyl-1H-pyrrole-3-carboxylic acid
CAS Number:
175276-50-3
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD00203866
IUPAC Name:
1,2,5-trimethylpyrrole-3-carboxylic acid
InChI:
InChI=1S/C8H11NO2/c1-5-4-7(8(10)11)6(2)9(5)3/h4H,1-3H3,(H,10,11)
InChI Key:
JTEBLTWGSAXWEE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(n(c1C)C)C
Properties
Complexity:
170  
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:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties