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2426-85-9 | Benzaldehyde,3-methoxy-2-[(phenylsulfonyl)oxy]-
CAS No: 2426-85-9 Catalog No: AG007NXM MDL No:
Product Description
Catalog Number:
AG007NXM
Chemical Name:
Benzaldehyde,3-methoxy-2-[(phenylsulfonyl)oxy]-
CAS Number:
2426-85-9
Molecular Formula:
C14H14O6S
Molecular Weight:
310.3224
IUPAC Name:
(2-formyl-6-methoxyphenyl) benzenesulfonate
InChI:
InChI=1S/C14H12O5S/c1-18-13-9-5-6-11(10-15)14(13)19-20(16,17)12-7-3-2-4-8-12/h2-10H,1H3
InChI Key:
PYRREPLERCADBI-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1ccccc1.COc1cccc(c1O)C=O
NSC Number:
32731
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.041g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.305g/mol
Monoisotopic Mass:
292.041g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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