Home Other Building Blocks 3,3-DIMETHYL-1-PYRIDIN-2-YLBUTAN-2-ONE

3,3-DIMETHYL-1-PYRIDIN-2-YLBUTAN-2-ONE

CAS No.:
34552-04-0
Catalog Number:
AG00BZ0O
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$142
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Product Description
Catalog Number:
AG00BZ0O
Chemical Name:
3,3-DIMETHYL-1-PYRIDIN-2-YLBUTAN-2-ONE
CAS Number:
34552-04-0
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD00052630
IUPAC Name:
3,3-dimethyl-1-pyridin-2-ylbutan-2-one
InChI:
InChI=1S/C11H15NO/c1-11(2,3)10(13)8-9-6-4-5-7-12-9/h4-7H,8H2,1-3H3
InChI Key:
BCCWJSAFGSJLPD-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)Cc1ccccn1
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties