200,000+ products from a single source!
sales@angenechem.com
2100-27-8 | Benzoic acid, 5-iodo-2-propoxy-
CAS No: 2100-27-8 Catalog No: AG002KJB MDL No:
Product Description
Catalog Number:
AG002KJB
Chemical Name:
Benzoic acid, 5-iodo-2-propoxy-
CAS Number:
2100-27-8
Molecular Formula:
C10H11IO3
Molecular Weight:
306.0970
IUPAC Name:
5-iodo-2-propoxybenzoic acid
InChI:
InChI=1S/C10H11IO3/c1-2-5-14-9-4-3-7(11)6-8(9)10(12)13/h3-4,6H,2,5H2,1H3,(H,12,13)
InChI Key:
XLTWMAGGMGEEIJ-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1C(=O)O)I
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.975g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.099g/mol
Monoisotopic Mass:
305.975g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.