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Home Carboxys Ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride

Ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride

CAS No.:
57980-74-2
Catalog Number:
AG00F1GK
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
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Product Description
Catalog Number:
AG00F1GK
Chemical Name:
Ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride
CAS Number:
57980-74-2
Molecular Formula:
C12H16ClNO2
Molecular Weight:
241.7139
MDL Number:
MFCD02369542
IUPAC Name:
ethyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride
InChI:
InChI=1S/C12H15NO2.ClH/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11;/h3-6,11,13H,2,7-8H2,1H3;1H
InChI Key:
GKLWWGAFDIKVQY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1NCc2c(C1)cccc2.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
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties