Home Aminos 2-[4-(3-aminopropyl)phenoxy]acetic acid hydrochloride

2-[4-(3-aminopropyl)phenoxy]acetic acid hydrochloride

CAS No.:
2126163-12-8
Catalog Number:
AG01ELJH
Molecular Formula:
C11H16ClNO3
Molecular Weight:
245.7026
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Product Description
Catalog Number:
AG01ELJH
Chemical Name:
2-[4-(3-aminopropyl)phenoxy]acetic acid hydrochloride
CAS Number:
2126163-12-8
Molecular Formula:
C11H16ClNO3
Molecular Weight:
245.7026
MDL Number:
MFCD30752543
IUPAC Name:
2-[4-(3-aminopropyl)phenoxy]acetic acid;hydrochloride
InChI:
InChI=1S/C11H15NO3.ClH/c12-7-1-2-9-3-5-10(6-4-9)15-8-11(13)14;/h3-6H,1-2,7-8,12H2,(H,13,14);1H
InChI Key:
MOVKHOVJDPVXEV-UHFFFAOYSA-N
SMILES:
NCCCc1ccc(cc1)OCC(=O)O.Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
245.703g/mol
Monoisotopic Mass:
245.082g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties