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1341862-19-8 | 4-(1,2,3,4-tetrahydroisoquinolin-2-yl)pyrrolidin-3-ol
CAS No: 1341862-19-8 Catalog No: AG01BBUV MDL No:MFCD18862353
Product Description
Catalog Number:
AG01BBUV
Chemical Name:
4-(1,2,3,4-tetrahydroisoquinolin-2-yl)pyrrolidin-3-ol
CAS Number:
1341862-19-8
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD18862353
IUPAC Name:
4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrolidin-3-ol
InChI:
InChI=1S/C13H18N2O/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
InChI Key:
YOMLWJZQKDDDDV-UHFFFAOYSA-N
SMILES:
OC1CNCC1N1CCc2c(C1)cccc2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.3g/mol
Monoisotopic Mass:
218.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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