Home Bromides 1072944-32-1
1072944-32-1,MFCD11504866
Catalog No.:AA003KXO
1072944-32-1 | 4-Bromo-N-(furan-2-ylmethyl)-3-methylbenzamide
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1g
95%
in stock  
$60.00
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5g
95%
in stock  
$180.00
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Technical Information
Catalog Number:
AA003KXO
Chemical Name:
4-Bromo-N-(furan-2-ylmethyl)-3-methylbenzamide
CAS Number:
1072944-32-1
Molecular Formula:
C13H12BrNO2
Molecular Weight:
294.1439
MDL Number:
MFCD11504866
IUPAC Name:
4-bromo-N-(furan-2-ylmethyl)-3-methylbenzamide
InChI:
InChI=1S/C13H12BrNO2/c1-9-7-10(4-5-12(9)14)13(16)15-8-11-3-2-6-17-11/h2-7H,8H2,1H3,(H,15,16)
InChI Key:
RLPAEHDFGVRAEK-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)C)Br)NCc1ccco1
Properties
Computed Properties
 
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.005g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
294.148g/mol
Monoisotopic Mass:
293.005g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
1072944-32-1 
4-Bromo-N-(furan-2-ylmethyl)-3-methylbenzamide 
AKOS015835275 
RTR-001433 
AJ-95880 
AX8242880 
BC2332727 
TR-001433 
Z6942 
A-4440 
4-Bromo-N-[(furan-2-yl)methyl]-3-methylbenzamide 
I01-11203 
N-(furan-2-ylmethyl) 4-bromo-3-methylbenzamide 
C13H12BrNO2 
N-(furan-2-ylmethyl)4-bromo-3-methylbenzamide 
ACMC-2098oj 
CTK4A5133 
DTXSID60674584 
ANW-15521 
MFCD11504866 
ZINC38537097 
Literature
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