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Home Other Building Blocks 1-Benzylpyrrolidin-3-one

1-Benzylpyrrolidin-3-one

CAS No.:
775-16-6
Catalog Number:
AG0032OG
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$13
- +
25g
97%
In Stock USA
United States
$44
- +
100g
97%
In Stock USA
United States
$150
- +
500g
97%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG0032OG
Chemical Name:
1-Benzylpyrrolidin-3-one
CAS Number:
775-16-6
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD00005342
IUPAC Name:
1-benzylpyrrolidin-3-one
InChI:
InChI=1S/C11H13NO/c13-11-6-7-12(9-11)8-10-4-2-1-3-5-10/h1-5H,6-9H2
InChI Key:
DHGMDHQNUNRMIN-UHFFFAOYSA-N
SMILES:
O=C1CCN(C1)Cc1ccccc1
EC Number:
212-274-0
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Cloning, sequence analysis, and expression in Escherichia coli of gene encoding N-Benzyl-3-pyrrolidinol dehydrogenase from Geotrichum capitatum. Journal of bioscience and bioengineering 20071101
Purification and characterization of alcohol dehydrogenase reducing N-benzyl-3-pyrrolidinone from Geotrichum capitatum. Journal of bioscience and bioengineering 20070201
Properties