Home Aminos 4-amino-3-(4-hydroxybutoxy)benzoic acid

4-amino-3-(4-hydroxybutoxy)benzoic acid

CAS No.:
1249548-46-6
Catalog Number:
AG01BVGO
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
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Product Description
Catalog Number:
AG01BVGO
Chemical Name:
4-amino-3-(4-hydroxybutoxy)benzoic acid
CAS Number:
1249548-46-6
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
MDL Number:
MFCD16154807
IUPAC Name:
4-amino-3-(4-hydroxybutoxy)benzoic acid
InChI:
InChI=1S/C11H15NO4/c12-9-4-3-8(11(14)15)7-10(9)16-6-2-1-5-13/h3-4,7,13H,1-2,5-6,12H2,(H,14,15)
InChI Key:
SAKYWUPGSPAUGN-UHFFFAOYSA-N
SMILES:
OCCCCOc1cc(ccc1N)C(=O)O
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
225.244g/mol
Monoisotopic Mass:
225.1g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties