Home Other Building Blocks 2,4-Bis(octylthio)-6-(4-hydroxy-3,5-di-tert-butylanilino)-1,3,5-triazine

2,4-Bis(octylthio)-6-(4-hydroxy-3,5-di-tert-butylanilino)-1,3,5-triazine

CAS No.:
991-84-4
Catalog Number:
AG0036UU
Molecular Formula:
C33H56N4OS2
Molecular Weight:
588.9539
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$20
- +
5g
95%
In Stock USA
United States
$64
- +
10g
95%
In Stock USA
United States
$113
- +
25g
95%
In Stock USA
United States
$225
- +
100g
98%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG0036UU
Chemical Name:
2,4-Bis(octylthio)-6-(4-hydroxy-3,5-di-tert-butylanilino)-1,3,5-triazine
CAS Number:
991-84-4
Molecular Formula:
C33H56N4OS2
Molecular Weight:
588.9539
MDL Number:
MFCD00134696
IUPAC Name:
4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol
InChI:
InChI=1S/C33H56N4OS2/c1-9-11-13-15-17-19-21-39-30-35-29(36-31(37-30)40-22-20-18-16-14-12-10-2)34-25-23-26(32(3,4)5)28(38)27(24-25)33(6,7)8/h23-24,38H,9-22H2,1-8H3,(H,34,35,36,37)
InChI Key:
QRLSTWVLSWCGBT-UHFFFAOYSA-N
SMILES:
CCCCCCCCSc1nc(SCCCCCCCC)nc(n1)Nc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
EC Number:
213-590-1
UNII:
O1Q826IX7H
NSC Number:
328455
Properties
Complexity:
603  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
588.39g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
588.958g/mol
Monoisotopic Mass:
588.39g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
13.4  
Properties