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Tilbroquinol

CAS No.:
7175-09-9
Catalog Number:
AG00FDKJ
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$498
- +
10mg
98%
1 week
United States
$623
- +
50mg
98%
1 week
United States
$1590
- +
Product Description
Catalog Number:
AG00FDKJ
Chemical Name:
Tilbroquinol
CAS Number:
7175-09-9
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
MDL Number:
MFCD00864659
IUPAC Name:
7-bromo-5-methylquinolin-8-ol
InChI:
InChI=1S/C10H8BrNO/c1-6-5-8(11)10(13)9-7(6)3-2-4-12-9/h2-5,13H,1H3
InChI Key:
JMOVFFLYGIQXMM-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c2c(c1O)nccc2
EC Number:
230-533-6
UNII:
P6SB125NHA
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.979g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.084g/mol
Monoisotopic Mass:
236.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Translating clinical findings into knowledge in drug safety evaluation--drug induced liver injury prediction system (DILIps). PLoS computational biology 20111201
Oxyquinoline toxicity. Lancet (London, England) 19830326
Properties