Home Sulfos 2,3-dihydro-1-benzoxepine-4-sulfonyl chloride

2,3-dihydro-1-benzoxepine-4-sulfonyl chloride

CAS No.:
1602704-82-4
Catalog Number:
AG01ABQY
Molecular Formula:
C10H9ClO3S
Molecular Weight:
244.6947
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Product Description
Catalog Number:
AG01ABQY
Chemical Name:
2,3-dihydro-1-benzoxepine-4-sulfonyl chloride
CAS Number:
1602704-82-4
Molecular Formula:
C10H9ClO3S
Molecular Weight:
244.6947
MDL Number:
MFCD26935978
IUPAC Name:
2,3-dihydro-1-benzoxepine-4-sulfonyl chloride
InChI:
InChI=1S/C10H9ClO3S/c11-15(12,13)9-5-6-14-10-4-2-1-3-8(10)7-9/h1-4,7H,5-6H2
InChI Key:
SIQCEPFBSLNZHE-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)C1=Cc2ccccc2OCC1
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.996g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.689g/mol
Monoisotopic Mass:
243.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties