Home Carboxys 2-(propan-2-yl)-1H-pyrrole-3-carboxylic acid

2-(propan-2-yl)-1H-pyrrole-3-carboxylic acid

CAS No.:
1521795-25-4
Catalog Number:
AG01B89U
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B89U
Chemical Name:
2-(propan-2-yl)-1H-pyrrole-3-carboxylic acid
CAS Number:
1521795-25-4
Molecular Formula:
C8H11NO2
Molecular Weight:
153.1784
MDL Number:
MFCD26598958
IUPAC Name:
2-propan-2-yl-1H-pyrrole-3-carboxylic acid
InChI:
InChI=1S/C8H11NO2/c1-5(2)7-6(8(10)11)3-4-9-7/h3-5,9H,1-2H3,(H,10,11)
InChI Key:
UAAPHTTZDABWPH-UHFFFAOYSA-N
SMILES:
CC(c1[nH]ccc1C(=O)O)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:
2  
Isotope Atom Count:
0
Molecular Weight:
153.181g/mol
Monoisotopic Mass:
153.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties