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Home Boronic acids 4-Methyl-3-(3-(4-methylpiperazin-1-yl)propoxy)phenylboronic acid

4-Methyl-3-(3-(4-methylpiperazin-1-yl)propoxy)phenylboronic acid

CAS No.:
1704064-31-2
Catalog Number:
AG00ARP9
Molecular Formula:
C15H25BN2O3
Molecular Weight:
292.1816
Pack Size
Purity
Availability
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Quantity
  
1g
95%
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United States
$829
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Product Description
Catalog Number:
AG00ARP9
Chemical Name:
4-Methyl-3-(3-(4-methylpiperazin-1-yl)propoxy)phenylboronic acid
CAS Number:
1704064-31-2
Molecular Formula:
C15H25BN2O3
Molecular Weight:
292.1816
MDL Number:
MFCD28384332
IUPAC Name:
[4-methyl-3-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]boronic acid
InChI:
InChI=1S/C15H25BN2O3/c1-13-4-5-14(16(19)20)12-15(13)21-11-3-6-18-9-7-17(2)8-10-18/h4-5,12,19-20H,3,6-11H2,1-2H3
InChI Key:
HOLVQFCYTSHUEA-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)CCCOc1cc(ccc1C)B(O)O
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.196g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
292.186g/mol
Monoisotopic Mass:
292.196g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties