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Cycloheptanone

CAS No.:
502-42-1
Catalog Number:
AG00361N
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$75
- +
500g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG00361N
Chemical Name:
Cycloheptanone
CAS Number:
502-42-1
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
MDL Number:
MFCD00004159
IUPAC Name:
cycloheptanone
InChI:
InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2
InChI Key:
CGZZMOTZOONQIA-UHFFFAOYSA-N
SMILES:
O=C1CCCCCC1
EC Number:
207-937-6
UNII:
QH80295937
NSC Number:
9471
Properties
Complexity:
76.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.089g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.172g/mol
Monoisotopic Mass:
112.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
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Synthesis of curcumin analogues as potential antioxidant, cancer chemopreventive agents. Archiv der Pharmazie 20040101
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Properties