Home Boronic acids 4-(Cyclopropylmethylthio)phenylboronic acid

4-(Cyclopropylmethylthio)phenylboronic acid

CAS No.:
1217501-03-5
Catalog Number:
AG0015RL
Molecular Formula:
C10H13BO2S
Molecular Weight:
208.0850
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$225
- +
5g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0015RL
Chemical Name:
4-(Cyclopropylmethylthio)phenylboronic acid
CAS Number:
1217501-03-5
Molecular Formula:
C10H13BO2S
Molecular Weight:
208.0850
MDL Number:
MFCD12546550
IUPAC Name:
[4-(cyclopropylmethylsulfanyl)phenyl]boronic acid
InChI:
InChI=1S/C10H13BO2S/c12-11(13)9-3-5-10(6-4-9)14-7-8-1-2-8/h3-6,8,12-13H,1-2,7H2
InChI Key:
SKUDUPVJZBDKND-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)SCC1CC1)O
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.073g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.082g/mol
Monoisotopic Mass:
208.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties