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88041-83-2 | Benzenesulfonyl chloride, 5-(1,1-dimethylethyl)-2-methoxy-
CAS No: 88041-83-2 Catalog No: AG004J4T MDL No:MFCD08457535
Product Description
Catalog Number:
AG004J4T
Chemical Name:
Benzenesulfonyl chloride, 5-(1,1-dimethylethyl)-2-methoxy-
CAS Number:
88041-83-2
Molecular Formula:
C11H15ClO3S
Molecular Weight:
262.7530
MDL Number:
MFCD08457535
IUPAC Name:
5-tert-butyl-2-methoxybenzenesulfonyl chloride
InChI:
InChI=1S/C11H15ClO3S/c1-11(2,3)8-5-6-9(15-4)10(7-8)16(12,13)14/h5-7H,1-4H3
InChI Key:
MMKJABSTFRSIQT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)Cl)C(C)(C)C
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.043g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.748g/mol
Monoisotopic Mass:
262.043g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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