Home Boronic acids 2-Bromomethyl-4-methoxycarbonylphenylboronic acid, pinacol ester

2-Bromomethyl-4-methoxycarbonylphenylboronic acid, pinacol ester

CAS No.:
1256388-92-7
Catalog Number:
AG00HID2
Molecular Formula:
C15H20BBrO4
Molecular Weight:
355.0319
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$375
- +
5g
95%
In Stock USA
United States
$1375
- +
Product Description
Catalog Number:
AG00HID2
Chemical Name:
2-Bromomethyl-4-methoxycarbonylphenylboronic acid, pinacol ester
CAS Number:
1256388-92-7
Molecular Formula:
C15H20BBrO4
Molecular Weight:
355.0319
MDL Number:
MFCD18383438
IUPAC Name:
methyl 3-(bromomethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C15H20BBrO4/c1-14(2)15(3,4)21-16(20-14)12-7-6-10(13(18)19-5)8-11(12)9-17/h6-8H,9H2,1-5H3
InChI Key:
IIIKWJORPDUKAI-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)CBr)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
383  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.064g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.035g/mol
Monoisotopic Mass:
354.064g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties