Home Aminos 2-{3-[2-(dimethylamino)ethoxy]phenyl}acetic acid hydrochloride

2-{3-[2-(dimethylamino)ethoxy]phenyl}acetic acid hydrochloride

CAS No.:
1607256-31-4
Catalog Number:
AG01AD2H
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
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Product Description
Catalog Number:
AG01AD2H
Chemical Name:
2-{3-[2-(dimethylamino)ethoxy]phenyl}acetic acid hydrochloride
CAS Number:
1607256-31-4
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
MDL Number:
MFCD26936229
IUPAC Name:
2-[3-[2-(dimethylamino)ethoxy]phenyl]acetic acid;hydrochloride
InChI:
InChI=1S/C12H17NO3.ClH/c1-13(2)6-7-16-11-5-3-4-10(8-11)9-12(14)15;/h3-5,8H,6-7,9H2,1-2H3,(H,14,15);1H
InChI Key:
NEWVYMGLADFBHH-UHFFFAOYSA-N
SMILES:
CN(CCOc1cccc(c1)CC(=O)O)C.Cl
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.73g/mol
Monoisotopic Mass:
259.098g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties