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1157922-06-9 | methyl N-(1,2,3,4-tetrahydroisoquinolin-5-yl)carbamate
CAS No: 1157922-06-9 Catalog No: AG019ZRY MDL No:MFCD12067067
Product Description
Catalog Number:
AG019ZRY
Chemical Name:
methyl N-(1,2,3,4-tetrahydroisoquinolin-5-yl)carbamate
CAS Number:
1157922-06-9
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD12067067
IUPAC Name:
methyl N-(1,2,3,4-tetrahydroisoquinolin-5-yl)carbamate
InChI:
InChI=1S/C11H14N2O2/c1-15-11(14)13-10-4-2-3-8-7-12-6-5-9(8)10/h2-4,12H,5-7H2,1H3,(H,13,14)
InChI Key:
FAURJKZTWDABDM-UHFFFAOYSA-N
SMILES:
COC(=O)Nc1cccc2c1CCNC2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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