Home Aminos N-[3-(aminomethyl)phenyl]-2-methylbutanamide hydrochloride

N-[3-(aminomethyl)phenyl]-2-methylbutanamide hydrochloride

CAS No.:
1172475-69-2
Catalog Number:
AG019UP2
Molecular Formula:
C12H19ClN2O
Molecular Weight:
242.7451
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Product Description
Catalog Number:
AG019UP2
Chemical Name:
N-[3-(aminomethyl)phenyl]-2-methylbutanamide hydrochloride
CAS Number:
1172475-69-2
Molecular Formula:
C12H19ClN2O
Molecular Weight:
242.7451
MDL Number:
MFCD11857895
IUPAC Name:
N-[3-(aminomethyl)phenyl]-2-methylbutanamide;hydrochloride
InChI:
InChI=1S/C12H18N2O.ClH/c1-3-9(2)12(15)14-11-6-4-5-10(7-11)8-13;/h4-7,9H,3,8,13H2,1-2H3,(H,14,15);1H
InChI Key:
KXXZOABNQQGQQW-UHFFFAOYSA-N
SMILES:
CCC(C(=O)Nc1cccc(c1)CN)C.Cl
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.119g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
242.747g/mol
Monoisotopic Mass:
242.119g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties