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1002727-89-0 | Benzenesulfonyl chloride, 4-(phenoxymethyl)-
CAS No: 1002727-89-0 Catalog No: AG0001FC MDL No:MFCD09966154
Product Description
Catalog Number:
AG0001FC
Chemical Name:
Benzenesulfonyl chloride, 4-(phenoxymethyl)-
CAS Number:
1002727-89-0
Molecular Formula:
C13H11ClO3S
Molecular Weight:
282.7426
MDL Number:
MFCD09966154
IUPAC Name:
4-(phenoxymethyl)benzenesulfonyl chloride
InChI:
InChI=1S/C13H11ClO3S/c14-18(15,16)13-8-6-11(7-9-13)10-17-12-4-2-1-3-5-12/h1-9H,10H2
InChI Key:
ITLWVYCIZYWFNW-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccc(cc1)COc1ccccc1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.012g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.738g/mol
Monoisotopic Mass:
282.012g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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