Home Other Building Blocks Ethanone, 1-(3,5-dimethyl-1H-pyrrol-2-yl)-

Ethanone, 1-(3,5-dimethyl-1H-pyrrol-2-yl)-

CAS No.:
1500-93-2
Catalog Number:
AG001M7R
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001M7R
Chemical Name:
Ethanone, 1-(3,5-dimethyl-1H-pyrrol-2-yl)-
CAS Number:
1500-93-2
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD00982312
IUPAC Name:
1-(3,5-dimethyl-1H-pyrrol-2-yl)ethanone
InChI:
InChI=1S/C8H11NO/c1-5-4-6(2)9-8(5)7(3)10/h4,9H,1-3H3
InChI Key:
KSZNMNSPWOIFPE-UHFFFAOYSA-N
SMILES:
CC(=O)c1[nH]c(cc1C)C
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties