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Home Carboxys L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid

L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid

CAS No.:
74163-81-8
Catalog Number:
AG00ICHD
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$19
- +
25g
97%
In Stock USA
United States
$44
- +
100g
97%
In Stock USA
United States
$100
- +
500g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00ICHD
Chemical Name:
L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid
CAS Number:
74163-81-8
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD00144533
IUPAC Name:
(3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H11NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-4,9,11H,5-6H2,(H,12,13)/t9-/m0/s1
InChI Key:
BWKMGYQJPOAASG-VIFPVBQESA-N
SMILES:
OC(=O)[C@H]1NCc2c(C1)cccc2 C10H11NO2
EC Number:
616-058-0
UNII:
737G46U1NP
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Literature
Title Journal
pH-Dependent nanostructure based on isoquinoline-cyclodextrin conjugate for thrombosis therapy. Nanomedicine : nanotechnology, biology, and medicine 20121001
A class of novel N-(3S-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-L-amino acid derivatives: their synthesis, anti-thrombotic activity evaluation, and 3D QSAR analysis. European journal of medicinal chemistry 20091201
(3S)-N-(L-Aminoacyl)-1,2,3,4-tetrahydroisoquinolines, a class of novel antithrombotic agents: synthesis, bioassay, 3D QSAR, and ADME analysis. Bioorganic & medicinal chemistry 20081101
Properties