Home Aminos 2-(3-amino-2-hydroxypropyl)-1,2-dihydroisoquinolin-1-one hydrochloride

2-(3-amino-2-hydroxypropyl)-1,2-dihydroisoquinolin-1-one hydrochloride

CAS No.:
2060052-57-3
Catalog Number:
AG01C017
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
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Product Description
Catalog Number:
AG01C017
Chemical Name:
2-(3-amino-2-hydroxypropyl)-1,2-dihydroisoquinolin-1-one hydrochloride
CAS Number:
2060052-57-3
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
MDL Number:
MFCD30497770
IUPAC Name:
2-(3-amino-2-hydroxypropyl)isoquinolin-1-one;hydrochloride
InChI:
InChI=1S/C12H14N2O2.ClH/c13-7-10(15)8-14-6-5-9-3-1-2-4-11(9)12(14)16;/h1-6,10,15H,7-8,13H2;1H
InChI Key:
JJFNLYFLMUJKAI-UHFFFAOYSA-N
SMILES:
NCC(Cn1ccc2c(c1=O)cccc2)O.Cl
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.082g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
254.714g/mol
Monoisotopic Mass:
254.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties