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Home Other Building Blocks (6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methanol

(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methanol

CAS No.:
4356-47-2
Catalog Number:
AG00DCT1
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
In Stock USA
United States
$137
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500mg
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$241
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1g
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$436
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2.5g
In Stock USA
United States
$964
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5g
In Stock USA
United States
$1776
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Product Description
Catalog Number:
AG00DCT1
Chemical Name:
(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methanol
CAS Number:
4356-47-2
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
MDL Number:
MFCD07366618
IUPAC Name:
(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methanol
InChI:
InChI=1S/C12H17NO3/c1-15-11-5-8-3-4-13-10(7-14)9(8)6-12(11)16-2/h5-6,10,13-14H,3-4,7H2,1-2H3
InChI Key:
JVLGDDNDVOSMSI-UHFFFAOYSA-N
SMILES:
OCC1NCCc2c1cc(OC)c(c2)OC
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
Ortho-rhom-bic polymorph of (6,7-dimeth-oxy-1,2,3,4-tetra-hydro-isoquinolin-1-yl)methanol. Acta crystallographica. Section E, Structure reports online 20110701
Properties