Home Carboxys 1-Isopropyl-1h-pyrrole-2-carboxylic acid

1-Isopropyl-1h-pyrrole-2-carboxylic acid

CAS No.:
1041644-48-7
Catalog Number:
AG00J2HF
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG00J2HF
Chemical Name:
1-Isopropyl-1h-pyrrole-2-carboxylic acid
CAS Number:
1041644-48-7
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD08704773
IUPAC Name:
1-propan-2-ylpyrrole-2-carboxylic acid
InChI:
InChI=1S/C8H11NO2/c1-6(2)9-5-3-4-7(9)8(10)11/h3-6H,1-2H3,(H,10,11)
InChI Key:
UBNKBSYOGPUMHA-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccn1C(C)C
Properties
Complexity:
156  
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:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties