Home Other Building Blocks 1-Phenylpentan-2-one

1-Phenylpentan-2-one

CAS No.:
6683-92-7
Catalog Number:
AG003EMP
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$69
- +
5g
95%
In Stock USA
United States
$207
- +
10g
95%
In Stock USA
United States
$350
- +
25g
95%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG003EMP
Chemical Name:
1-Phenylpentan-2-one
CAS Number:
6683-92-7
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
MDL Number:
MFCD00027142
IUPAC Name:
1-phenylpentan-2-one
InChI:
InChI=1S/C11H14O/c1-2-6-11(12)9-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3
InChI Key:
NFKAWBGFIMBUMB-UHFFFAOYSA-N
SMILES:
CCCC(=O)Cc1ccccc1
EC Number:
229-726-8
UNII:
36VW7X5C4P
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
[Analysis of head volatile constituents of Polyonum cuspidatum flower by HS-GC/MS]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20120201
Properties