Home Other Building Blocks methyl 2-(1,2,3,4-tetrahydroisoquinolin-4-yl)acetate hydrochloride

methyl 2-(1,2,3,4-tetrahydroisoquinolin-4-yl)acetate hydrochloride

CAS No.:
16261-33-9
Catalog Number:
AG01EHVA
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
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Product Description
Catalog Number:
AG01EHVA
Chemical Name:
methyl 2-(1,2,3,4-tetrahydroisoquinolin-4-yl)acetate hydrochloride
CAS Number:
16261-33-9
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
MDL Number:
MFCD31666104
IUPAC Name:
methyl 2-(1,2,3,4-tetrahydroisoquinolin-4-yl)acetate;hydrochloride
InChI:
InChI=1S/C12H15NO2.ClH/c1-15-12(14)6-10-8-13-7-9-4-2-3-5-11(9)10;/h2-5,10,13H,6-8H2,1H3;1H
InChI Key:
FVMZUMBRSHPBQF-UHFFFAOYSA-N
SMILES:
COC(=O)CC1CNCc2c1cccc2.Cl
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.087g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.715g/mol
Monoisotopic Mass:
241.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties