200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1395417-57-8
1395417-57-8 | 3-Oxetanemethanol, 3-(4-methylbenzenesulfonate)
CAS No: 1395417-57-8 Catalog No: AG001B75 MDL No:MFCD27987281
Product Description
Catalog Number:
AG001B75
Chemical Name:
3-Oxetanemethanol, 3-(4-methylbenzenesulfonate)
CAS Number:
1395417-57-8
Molecular Formula:
C33H42O12S3
Molecular Weight:
726.8744
MDL Number:
MFCD27987281
IUPAC Name:
oxetan-3-ylmethyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C11H14O4S/c1-9-2-4-11(5-3-9)16(12,13)15-8-10-6-14-7-10/h2-5,10H,6-8H2,1H3
InChI Key:
DZDXQYOMYPRXBA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)OCC1COC1.Cc1ccc(cc1)S(=O)(=O)OCC1COC1.Cc1ccc(cc1)S(=O)(=O)OCC1COC1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.061g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.289g/mol
Monoisotopic Mass:
242.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.