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81185-32-2 | 1-Naphthalenol, 5,6,7,8-tetrahydro-7-(methylamino)-, hydrobromide
CAS No: 81185-32-2 Catalog No: AG005FCS MDL No:
Product Description
Catalog Number:
AG005FCS
Chemical Name:
1-Naphthalenol, 5,6,7,8-tetrahydro-7-(methylamino)-, hydrobromide
CAS Number:
81185-32-2
Molecular Formula:
C11H16BrNO
Molecular Weight:
258.1548
IUPAC Name:
7-(methylamino)-5,6,7,8-tetrahydronaphthalen-1-ol;hydrobromide
InChI:
InChI=1S/C11H15NO.BrH/c1-12-9-6-5-8-3-2-4-11(13)10(8)7-9;/h2-4,9,12-13H,5-7H2,1H3;1H
InChI Key:
FLRVAXXZLWZKFS-UHFFFAOYSA-N
SMILES:
CNC1CCc2c(C1)c(O)ccc2.Br
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
258.159g/mol
Monoisotopic Mass:
257.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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