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Home Aminos 4-(dimethylamino)-4-phenylbutanoic acid hydrochloride

4-(dimethylamino)-4-phenylbutanoic acid hydrochloride

CAS No.:
1820705-88-1
Catalog Number:
AG01AMZ3
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG01AMZ3
Chemical Name:
4-(dimethylamino)-4-phenylbutanoic acid hydrochloride
CAS Number:
1820705-88-1
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD29034085
IUPAC Name:
4-(dimethylamino)-4-phenylbutanoic acid;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-13(2)11(8-9-12(14)15)10-6-4-3-5-7-10;/h3-7,11H,8-9H2,1-2H3,(H,14,15);1H
InChI Key:
MWISTSDSIVWZFS-UHFFFAOYSA-N
SMILES:
CN(C(c1ccccc1)CCC(=O)O)C.Cl
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.731g/mol
Monoisotopic Mass:
243.103g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties