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CHEMHERE CHEM11131

CAS No.:
1303510-64-6
Catalog Number:
AG01BM53
Molecular Formula:
C11H13ClO3S
Molecular Weight:
260.7371
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Product Description
Catalog Number:
AG01BM53
Chemical Name:
CHEMHERE CHEM11131
CAS Number:
1303510-64-6
Molecular Formula:
C11H13ClO3S
Molecular Weight:
260.7371
MDL Number:
MFCD27943210
IUPAC Name:
3-phenylmethoxycyclobutane-1-sulfonyl chloride
InChI:
InChI=1S/C11H13ClO3S/c12-16(13,14)11-6-10(7-11)15-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2
InChI Key:
AUYZABLHRWXAHI-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)C1CC(C1)OCc1ccccc1
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.027g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.732g/mol
Monoisotopic Mass:
260.027g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties