Home Other Building Blocks DODECYL ISOTHIOCYANATE

DODECYL ISOTHIOCYANATE

CAS No.:
1072-32-8
Catalog Number:
AG003PVQ
Molecular Formula:
C13H25NS
Molecular Weight:
227.4093
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003PVQ
Chemical Name:
DODECYL ISOTHIOCYANATE
CAS Number:
1072-32-8
Molecular Formula:
C13H25NS
Molecular Weight:
227.4093
MDL Number:
MFCD00041121
IUPAC Name:
1-isothiocyanatododecane
InChI:
InChI=1S/C13H25NS/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15/h2-12H2,1H3
InChI Key:
LPVQVNLMFKGGCH-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCN=C=S
UNII:
572250J55E
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.171g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.41g/mol
Monoisotopic Mass:
227.171g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  
Properties