200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 113966-01-1
113966-01-1 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-[(propylthio)methyl]-
CAS No: 113966-01-1 Catalog No: AG000A6J MDL No:
Product Description
Catalog Number:
AG000A6J
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[(propylthio)methyl]-
CAS Number:
113966-01-1
Molecular Formula:
C18H30OS
Molecular Weight:
294.4952
IUPAC Name:
2,6-ditert-butyl-4-(propylsulfanylmethyl)phenol
InChI:
InChI=1S/C18H30OS/c1-8-9-20-12-13-10-14(17(2,3)4)16(19)15(11-13)18(5,6)7/h10-11,19H,8-9,12H2,1-7H3
InChI Key:
HUMVRMOMWWURIC-UHFFFAOYSA-N
SMILES:
CCCSCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.202g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.497g/mol
Monoisotopic Mass:
294.202g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.