200,000+ products from a single source!
sales@angenechem.com
120517-37-5 | 3-Butyn-2-ol, 4-(4-iodophenyl)-2-methyl-
CAS No: 120517-37-5 Catalog No: AG0080YY MDL No:
Product Description
Catalog Number:
AG0080YY
Chemical Name:
3-Butyn-2-ol, 4-(4-iodophenyl)-2-methyl-
CAS Number:
120517-37-5
Molecular Formula:
C11H11IO
Molecular Weight:
286.1089
IUPAC Name:
4-(4-iodophenyl)-2-methylbut-3-yn-2-ol
InChI:
InChI=1S/C11H11IO/c1-11(2,13)8-7-9-3-5-10(12)6-4-9/h3-6,13H,1-2H3
InChI Key:
KGIZFRNNKXSQAB-UHFFFAOYSA-N
SMILES:
CC(C#Cc1ccc(cc1)I)(O)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.112g/mol
Monoisotopic Mass:
285.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.