200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 141682-08-8
141682-08-8 | Benzene, 1,1'-oxybis[4-[[2-[(4-methylphenyl)thio]ethyl]sulfonyl]- (9CI)
CAS No: 141682-08-8 Catalog No: AG001GVT MDL No:
Product Description
Catalog Number:
AG001GVT
Chemical Name:
Benzene, 1,1'-oxybis[4-[[2-[(4-methylphenyl)thio]ethyl]sulfonyl]- (9CI)
CAS Number:
141682-08-8
Molecular Formula:
C30H30O5S4
Molecular Weight:
598.8162
IUPAC Name:
1-methyl-4-[2-[4-[4-[2-(4-methylphenyl)sulfanylethylsulfonyl]phenoxy]phenyl]sulfonylethylsulfanyl]benzene
InChI:
InChI=1S/C30H30O5S4/c1-23-3-11-27(12-4-23)36-19-21-38(31,32)29-15-7-25(8-16-29)35-26-9-17-30(18-10-26)39(33,34)22-20-37-28-13-5-24(2)6-14-28/h3-18H,19-22H2,1-2H3
InChI Key:
BSOXFNUHMAMEJZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)SCCS(=O)(=O)c1ccc(cc1)Oc1ccc(cc1)S(=O)(=O)CCSc1ccc(cc1)C
Properties
Complexity:
833
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
598.098g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
598.805g/mol
Monoisotopic Mass:
598.098g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.