200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 915401-98-8
915401-98-8 | 3-(ALLYLTHIO)-BENZENEBORONIC ACID
CAS No: 915401-98-8 Catalog No: AG006L6K MDL No:
Product Description
Catalog Number:
AG006L6K
Chemical Name:
3-(ALLYLTHIO)-BENZENEBORONIC ACID
CAS Number:
915401-98-8
Molecular Formula:
C9H11BO2S
Molecular Weight:
194.0584
IUPAC Name:
(3-prop-2-enylsulfanylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO2S/c1-2-6-13-9-5-3-4-8(7-9)10(11)12/h2-5,7,11-12H,1,6H2
InChI Key:
GBDGTVBVLHZGFE-UHFFFAOYSA-N
SMILES:
C=CCSc1cccc(c1)B(O)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.057g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.055g/mol
Monoisotopic Mass:
194.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.