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Home Other Building Blocks 6-Methylheptyl 2-mercaptoacetate

6-Methylheptyl 2-mercaptoacetate

CAS No.:
25103-09-7
Catalog Number:
AG003R43
Molecular Formula:
C10H20O2S
Molecular Weight:
204.3296
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%(GC)
In Stock USA
United States
$60
- +
25g
98%(GC)
In Stock USA
United States
$151
- +
Product Description
Catalog Number:
AG003R43
Chemical Name:
6-Methylheptyl 2-mercaptoacetate
CAS Number:
25103-09-7
Molecular Formula:
C10H20O2S
Molecular Weight:
204.3296
MDL Number:
MFCD00022088
IUPAC Name:
6-methylheptyl 2-sulfanylacetate
InChI:
InChI=1S/C10H20O2S/c1-9(2)6-4-3-5-7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
InChI Key:
RZBBHEJLECUBJT-UHFFFAOYSA-N
SMILES:
SCC(=O)OCCCCCC(C)C
EC Number:
246-613-9
UNII:
3404M9ZDTB
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.118g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.328g/mol
Monoisotopic Mass:
204.118g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
27.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Literature
Title Journal
Final amended report on the safety assessment of Ammonium Thioglycolate, Butyl Thioglycolate, Calcium Thioglycolate, Ethanolamine Thioglycolate, Ethyl Thioglycolate, Glyceryl Thioglycolate, Isooctyl Thioglycolate, Isopropyl Thioglycolate, Magnesium Thioglycolate, Methyl Thioglycolate, Potassium Thioglycolate, Sodium Thioglycolate, and Thioglycolic Acid. International journal of toxicology 20090101
Properties