Home Other Building Blocks 1-(4-phenyl-1H-pyrrol-3-yl)ethan-1-one

1-(4-phenyl-1H-pyrrol-3-yl)ethan-1-one

CAS No.:
40167-28-0
Catalog Number:
AG01A5I6
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A5I6
Chemical Name:
1-(4-phenyl-1H-pyrrol-3-yl)ethan-1-one
CAS Number:
40167-28-0
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
MDL Number:
MFCD03078160
IUPAC Name:
1-(4-phenyl-1H-pyrrol-3-yl)ethanone
InChI:
InChI=1S/C12H11NO/c1-9(14)11-7-13-8-12(11)10-5-3-2-4-6-10/h2-8,13H,1H3
InChI Key:
HTTOZWJDRBYWHH-UHFFFAOYSA-N
SMILES:
CC(=O)c1c[nH]cc1c1ccccc1
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties