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GR148672X

CAS No.:
263890-70-6
Catalog Number:
AG00BGLC
Molecular Formula:
C15H11F3N2O2S
Molecular Weight:
340.3202
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$223
- +
10mg
99%
1 week
United States
$335
- +
25mg
99%
1 week
United States
$543
- +
50mg
99%
1 week
United States
$751
- +
100mg
99%
1 week
United States
$1168
- +
Product Description
Catalog Number:
AG00BGLC
Chemical Name:
GR148672X
CAS Number:
263890-70-6
Molecular Formula:
C15H11F3N2O2S
Molecular Weight:
340.3202
MDL Number:
MFCD00096392
IUPAC Name:
1,1,1-trifluoro-4-hydroxy-3-[(3-methylphenyl)diazenyl]-4-thiophen-2-ylbut-3-en-2-one
InChI:
InChI=1S/C15H11F3N2O2S/c1-9-4-2-5-10(8-9)19-20-12(14(22)15(16,17)18)13(21)11-6-3-7-23-11/h2-8,21H,1H3
InChI Key:
OETQEFUTOKYBSL-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)N/N=C(\C(=O)C(F)(F)F)/C(=O)c1cccs1
Properties
Complexity:
505  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.049g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
340.32g/mol
Monoisotopic Mass:
340.049g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
90.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.2  
Properties