Home Aminos 1-[4-(Dimethylamino)phenyl]octahydro-4a(2h)-isoquinolinol hydrochloride

1-[4-(Dimethylamino)phenyl]octahydro-4a(2h)-isoquinolinol hydrochloride

CAS No.:
1212099-46-1
Catalog Number:
AG00J3SF
Molecular Formula:
C17H27ClN2O
Molecular Weight:
310.8621
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00J3SF
Chemical Name:
1-[4-(Dimethylamino)phenyl]octahydro-4a(2h)-isoquinolinol hydrochloride
CAS Number:
1212099-46-1
Molecular Formula:
C17H27ClN2O
Molecular Weight:
310.8621
MDL Number:
MFCD09870094
IUPAC Name:
1-[4-(dimethylamino)phenyl]-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol;hydrochloride
InChI:
InChI=1S/C17H26N2O.ClH/c1-19(2)14-8-6-13(7-9-14)16-15-5-3-4-10-17(15,20)11-12-18-16;/h6-9,15-16,18,20H,3-5,10-12H2,1-2H3;1H
InChI Key:
XLWAKCBKZCYQPU-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)C1NCCC2(C1CCCC2)O)C.Cl
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.181g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
310.866g/mol
Monoisotopic Mass:
310.181g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
Properties