200,000+ products from a single source!
sales@angenechem.com
71984-04-8 | 2-Propyn-1-ol, 3-iodo-, 4-methylbenzenesulfonate
CAS No: 71984-04-8 Catalog No: AG005EBU MDL No:
Product Description
Catalog Number:
AG005EBU
Chemical Name:
2-Propyn-1-ol, 3-iodo-, 4-methylbenzenesulfonate
CAS Number:
71984-04-8
Molecular Formula:
C10H11IO4S
Molecular Weight:
354.1614
IUPAC Name:
3-iodoprop-2-yn-1-ol;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H8O3S.C3H3IO/c1-6-2-4-7(5-3-6)11(8,9)10;4-2-1-3-5/h2-5H,1H3,(H,8,9,10);5H,3H2
InChI Key:
IXTUJVMPISEQOG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)O.OCC#CI
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.942g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
354.158g/mol
Monoisotopic Mass:
353.942g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.