Text Search
Structure Search

1-cyclohexyl-3-[(4-methylbenzenesulfonyl)oxy]-1-phenylpropan-1-ol

1-cyclohexyl-3-[(4-methylbenzenesulfonyl)oxy]-1-phenylpropan-1-ol

Formula: C22H28O4S

SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCC(O)(C1CCCCC1)C1=CC=CC=C1

IUPAC: 1-cyclohexyl-3-[(4-methylbenzenesulfonyl)oxy]-1-phenylpropan-1-ol

InChI: InChI=1/C22H28O4S/c1-18-12-14-21(15-13-18)27(24,25)26-17-16-22(23,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20,23H,3,6-7,10-11,16-17H2,1H3

Composition: C (68.01%), H (7.26%), O (16.47%), S (8.25%)

Molar Mass: 388.52

Atom Count: 55

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 388.170830556
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey IUSABRDBRWPFEW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 107.28
Topological Polar Surface Area 63.6
Polarizability 42.97
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H28O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote