Home Aminos 5-Amino-2-(((tetrahydrofuran-2-yl)methyl)amino)benzoic acid

5-Amino-2-(((tetrahydrofuran-2-yl)methyl)amino)benzoic acid

CAS No.:
896717-80-9
Catalog Number:
AG0043SO
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG0043SO
Chemical Name:
5-Amino-2-(((tetrahydrofuran-2-yl)methyl)amino)benzoic acid
CAS Number:
896717-80-9
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
MDL Number:
MFCD07657462
IUPAC Name:
5-amino-2-(oxolan-2-ylmethylamino)benzoic acid
InChI:
InChI=1S/C12H16N2O3/c13-8-3-4-11(10(6-8)12(15)16)14-7-9-2-1-5-17-9/h3-4,6,9,14H,1-2,5,7,13H2,(H,15,16)
InChI Key:
WDIRKHDCKISVHQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(=O)O)NCC1CCCO1
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
236.271g/mol
Monoisotopic Mass:
236.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties