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1803584-11-3 | 4-(1,2,3,4-tetrahydroisoquinolin-2-yl)pyrrolidin-3-ol dihydrochloride
CAS No: 1803584-11-3 Catalog No: AG01BBUU MDL No:MFCD28714616
Product Description
Catalog Number:
AG01BBUU
Chemical Name:
4-(1,2,3,4-tetrahydroisoquinolin-2-yl)pyrrolidin-3-ol dihydrochloride
CAS Number:
1803584-11-3
Molecular Formula:
C13H20Cl2N2O
Molecular Weight:
291.2167
MDL Number:
MFCD28714616
IUPAC Name:
4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrolidin-3-ol;dihydrochloride
InChI:
InChI=1S/C13H18N2O.2ClH/c16-13-8-14-7-12(13)15-6-5-10-3-1-2-4-11(10)9-15;;/h1-4,12-14,16H,5-9H2;2*1H
InChI Key:
CIYIORVEVUNHNZ-UHFFFAOYSA-N
SMILES:
OC1CNCC1N1CCc2c(C1)cccc2.Cl.Cl
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
291.216g/mol
Monoisotopic Mass:
290.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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