200,000+ products from a single source!
sales@angenechem.com
88041-72-9 | Benzene, 2-[(chloromethyl)sulfonyl]-4-(1,1-dimethylethyl)-1-methoxy-
CAS No: 88041-72-9 Catalog No: AG004G45 MDL No:
Product Description
Catalog Number:
AG004G45
Chemical Name:
Benzene, 2-[(chloromethyl)sulfonyl]-4-(1,1-dimethylethyl)-1-methoxy-
CAS Number:
88041-72-9
Molecular Formula:
C12H17ClO3S
Molecular Weight:
276.7796
IUPAC Name:
4-tert-butyl-2-(chloromethylsulfonyl)-1-methoxybenzene
InChI:
InChI=1S/C12H17ClO3S/c1-12(2,3)9-5-6-10(16-4)11(7-9)17(14,15)8-13/h5-7H,8H2,1-4H3
InChI Key:
OYWQRSOXSNVDNE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)CCl)C(C)(C)C
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.059g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.775g/mol
Monoisotopic Mass:
276.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.