Home Boronic acids 3-(1-Pyrrolidinoethyl)phenylboronic acid

3-(1-Pyrrolidinoethyl)phenylboronic acid

CAS No.:
1256355-44-8
Catalog Number:
AG000O4E
Molecular Formula:
C12H18BNO2
Molecular Weight:
219.0878
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$63
- +
5g
95%
In Stock USA
United States
$216
- +
25g
97%
In Stock USA
United States
$899
- +
Product Description
Catalog Number:
AG000O4E
Chemical Name:
3-(1-Pyrrolidinoethyl)phenylboronic acid
CAS Number:
1256355-44-8
Molecular Formula:
C12H18BNO2
Molecular Weight:
219.0878
MDL Number:
MFCD09864340
IUPAC Name:
[3-(1-pyrrolidin-1-ylethyl)phenyl]boronic acid
InChI:
InChI=1S/C12H18BNO2/c1-10(14-7-2-3-8-14)11-5-4-6-12(9-11)13(15)16/h4-6,9-10,15-16H,2-3,7-8H2,1H3
InChI Key:
OSQBDXBDCHOEAV-UHFFFAOYSA-N
SMILES:
CC(c1cccc(c1)B(O)O)N1CCCC1
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.143g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.091g/mol
Monoisotopic Mass:
219.143g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties