129244-98-0,MFCD03093719
Catalog No.:AA000YYE

129244-98-0 | Heptane, 1-isothiocyanato-7-(methylsulfinyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10mg
≥98%
2 weeks  
$506.00   $354.00
- +
25mg
≥98%
2 weeks  
$1,036.00   $725.00
- +
50mg
≥98%
2 weeks  
$1,588.00   $1,112.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA000YYE
Chemical Name:
Heptane, 1-isothiocyanato-7-(methylsulfinyl)-
CAS Number:
129244-98-0
Molecular Formula:
C9H17NOS2
Molecular Weight:
219.3674
MDL Number:
MFCD03093719
SMILES:
S=C=NCCCCCCCS(=O)C
Properties
Computed Properties
 
Complexity:
188  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Literature

Title: Broccoli and watercress suppress matrix metalloproteinase-9 activity and invasiveness of human MDA-MB-231 breast cancer cells.

Journal: Toxicology and applied pharmacology 20051201

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SDS
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Tags:129244-98-0 Molecular Formula|129244-98-0 MDL|129244-98-0 SMILES|129244-98-0 Heptane, 1-isothiocyanato-7-(methylsulfinyl)-
Catalog No.: AA000YYE
129244-98-0,MFCD03093719
129244-98-0 | Heptane, 1-isothiocyanato-7-(methylsulfinyl)-
Pack Size: 10mg
Purity: ≥98%
2 weeks
$506.00 $354.00
Pack Size: 25mg
Purity: ≥98%
2 weeks
$1,036.00 $725.00
Pack Size: 50mg
Purity: ≥98%
2 weeks
$1,588.00 $1,112.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA000YYE
Chemical Name: Heptane, 1-isothiocyanato-7-(methylsulfinyl)-
CAS Number: 129244-98-0
Molecular Formula: C9H17NOS2
Molecular Weight: 219.3674
MDL Number: MFCD03093719
SMILES: S=C=NCCCCCCCS(=O)C
Properties
Complexity: 188  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Literature fold

Title: Broccoli and watercress suppress matrix metalloproteinase-9 activity and invasiveness of human MDA-MB-231 breast cancer cells.

Journal: Toxicology and applied pharmacology20051201

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