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Brofoxine

CAS No.:
21440-97-1
Catalog Number:
AG00I45A
Molecular Formula:
C10H10BrNO2
Molecular Weight:
256.0959
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$69
- +
1g
95%
In Stock USA
United States
$175
- +
5g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG00I45A
Chemical Name:
Brofoxine
CAS Number:
21440-97-1
Molecular Formula:
C10H10BrNO2
Molecular Weight:
256.0959
MDL Number:
MFCD00866701
IUPAC Name:
6-bromo-4,4-dimethyl-1H-3,1-benzoxazin-2-one
InChI:
InChI=1S/C10H10BrNO2/c1-10(2)7-5-6(11)3-4-8(7)12-9(13)14-10/h3-5H,1-2H3,(H,12,13)
InChI Key:
JRXGULDSFFLUAO-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccc(cc2C(O1)(C)C)Br
EC Number:
244-389-7
UNII:
6P1O8U403T
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.989g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.099g/mol
Monoisotopic Mass:
254.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties