Home Bromides 1021919-24-3
1021919-24-3,MFCD18434446
Catalog No.:AA0006SH
1021919-24-3 | 1-BOC-4-Bromo-3-methylpyrazole
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Purity
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100mg
95%
in stock  
$62.00   $43.00
- +
250mg
95%
in stock  
$118.00   $83.00
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1g
95%
in stock  
$172.00   $120.00
- +
5g
95%
in stock  
$762.00   $534.00
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  • Technical Information
  • Properties
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0006SH
Chemical Name:
1-BOC-4-Bromo-3-methylpyrazole
CAS Number:
1021919-24-3
Molecular Formula:
C9H13BrN2O2
Molecular Weight:
261.1157
MDL Number:
MFCD18434446
IUPAC Name:
tert-butyl 4-bromo-3-methylpyrazole-1-carboxylate
InChI:
InChI=1S/C9H13BrN2O2/c1-6-7(10)5-12(11-6)8(13)14-9(2,3)4/h5H,1-4H3
InChI Key:
LRPOLTGTSAIHRO-UHFFFAOYSA-N
SMILES:
Brc1cn(nc1C)C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.016g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.119g/mol
Monoisotopic Mass:
260.016g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Synonyms
 
1021919-24-3 
tert-Butyl 4-bromo-3-methyl-1H-pyrazole-1-carboxylate 
ANW-14664 
MFCD18434446 
ZINC65337227 
AKOS015908393 
FCH1375089 
SB12355 
DA-16241 
AJ-115047 
AX8240257 
TC-103409 
1-BOC-4-Bromo-3-methylpyrazole 
CS-0037393 
FT-0715933 
Z6514 
tert-butyl 4-bromo-3-methylpyrazole-1-carboxylate 
I14-25023 
1H-Pyrazole-1-carboxylic acid, 4-bromo-3-methyl-, 1,1-dimethylethyl ester 
C9H13BrN2O2 
tert-Butyl4-bromo-3-methyl-1H-pyrazole-1-carboxylate 
SCHEMBL481939 
ACMC-20980q 
CTK8A9030 
KS-00001BBS 
DTXSID00682067 
LRPOLTGTSAIHRO-UHFFFAOYSA-N 
N-Boc-4-bromo-3-methyl-pyrazole 
Literature
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