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122396-68-3 | Benzene, [[2-(phenylmethoxy)ethyl]sulfonyl]-
CAS No: 122396-68-3 Catalog No: AG00176G MDL No:
Product Description
Catalog Number:
AG00176G
Chemical Name:
Benzene, [[2-(phenylmethoxy)ethyl]sulfonyl]-
CAS Number:
122396-68-3
Molecular Formula:
C15H16O3S
Molecular Weight:
276.3507
IUPAC Name:
2-(benzenesulfonyl)ethoxymethylbenzene
InChI:
InChI=1S/C15H16O3S/c16-19(17,15-9-5-2-6-10-15)12-11-18-13-14-7-3-1-4-8-14/h1-10H,11-13H2
InChI Key:
RKVVKAQSAPAVGC-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)CCOCc1ccccc1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.082g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.35g/mol
Monoisotopic Mass:
276.082g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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