Home Carboxys (S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid, HCl

(S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid, HCl

CAS No.:
77497-95-1
Catalog Number:
AG008OYM
Molecular Formula:
C10H12ClNO2
Molecular Weight:
213.6608
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$38
- +
25g
95%
In Stock USA
United States
$94
- +
100g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG008OYM
Chemical Name:
(S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid, HCl
CAS Number:
77497-95-1
Molecular Formula:
C10H12ClNO2
Molecular Weight:
213.6608
MDL Number:
MFCD00800357
IUPAC Name:
(3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C10H11NO2.ClH/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9;/h1-4,9,11H,5-6H2,(H,12,13);1H/t9-;/m0./s1
InChI Key:
FXHCFPUEIDRTMR-FVGYRXGTSA-N
SMILES:
OC(=O)[C@H]1NCc2c(C1)cccc2.Cl
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
213.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
213.661g/mol
Monoisotopic Mass:
213.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties