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Home Aminos 2-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)ethanol

2-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)ethanol

CAS No.:
626218-06-2
Catalog Number:
AG01AHW4
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
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Product Description
Catalog Number:
AG01AHW4
Chemical Name:
2-((1,2,3,4-tetrahydronaphthalen-1-yl)amino)ethanol
CAS Number:
626218-06-2
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD04035520
IUPAC Name:
2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethanol
InChI:
InChI=1S/C12H17NO/c14-9-8-13-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12-14H,3,5,7-9H2
InChI Key:
ATHCMLMFXXTYEA-UHFFFAOYSA-N
SMILES:
OCCNC1CCCc2c1cccc2
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties