Home Carboxys methyl 4-phenyl-1H-pyrrole-2-carboxylate

methyl 4-phenyl-1H-pyrrole-2-carboxylate

CAS No.:
903560-42-9
Catalog Number:
AG01CA6R
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01CA6R
Chemical Name:
methyl 4-phenyl-1H-pyrrole-2-carboxylate
CAS Number:
903560-42-9
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
MDL Number:
MFCD24556567
IUPAC Name:
methyl 4-phenyl-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C12H11NO2/c1-15-12(14)11-7-10(8-13-11)9-5-3-2-4-6-9/h2-8,13H,1H3
InChI Key:
HTDLNIQLELERCP-UHFFFAOYSA-N
SMILES:
COC(=O)c1[nH]cc(c1)c1ccccc1
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties