Home Aminos 3-(dimethylamino)-3-phenylpropanoic acid hydrochloride

3-(dimethylamino)-3-phenylpropanoic acid hydrochloride

CAS No.:
85608-26-0
Catalog Number:
AG01BDGP
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
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Product Description
Catalog Number:
AG01BDGP
Chemical Name:
3-(dimethylamino)-3-phenylpropanoic acid hydrochloride
CAS Number:
85608-26-0
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
MDL Number:
MFCD28023624
IUPAC Name:
3-(dimethylamino)-3-phenylpropanoic acid;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c1-12(2)10(8-11(13)14)9-6-4-3-5-7-9;/h3-7,10H,8H2,1-2H3,(H,13,14);1H
InChI Key:
RQQZWCPAQWVRTC-UHFFFAOYSA-N
SMILES:
CN(C(c1ccccc1)CC(=O)O)C.Cl
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties