Home Bromides 1000342-30-2
1000342-30-2,MFCD09749941
Catalog No.:AA0000FU
1000342-30-2 | Methyl 5-bromo-1H-indazole-6-carboxylate
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500mg
1 week  
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1g
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000FU
Chemical Name:
Methyl 5-bromo-1H-indazole-6-carboxylate
CAS Number:
1000342-30-2
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
MDL Number:
MFCD09749941
IUPAC Name:
methyl 5-bromo-1H-indazole-6-carboxylate
InChI:
InChI=1S/C9H7BrN2O2/c1-14-9(13)6-3-8-5(2-7(6)10)4-11-12-8/h2-4H,1H3,(H,11,12)
InChI Key:
OMGXGABLIDYSNN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2[nH]ncc2cc1Br
Properties
Computed Properties
 
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Synonyms
 
Methyl 5-bromo-1H-indazole-6-carboxylate 
1000342-30-2 
ZX-RL001872 
0043AA 
ANW-64407 
ZINC14986125 
AKOS016006394 
CS-W005943 
FCH1393001 
SS-6015 
AC-29534 
AJ-66519 
AK103865 
OR305115 
QC-10673 
SC-89363 
SY035923 
5-Bromo-methyl [1H]indazole-6-carboxylate 
AB0092364 
AX8235404 
TC-153152 
FT-0741459 
MFCD09749941 (95%) 
5-bromo-1H-Indazole-6-carboxylic acid methyl ester 
L-1465 
Methyl 5-bromo-1H-indazole-6-carboxylate, 95% 
1H-Indazole-6-carboxylic acid, 5-bromo-, methyl ester 
C9H7BrN2O2 
methyl 5-bromo-1H-indazole-6-carboxylate, 95% - 1G 1g 
MFCD09749941 
Methyl5-Bromo-1H-indazole-6-carboxylate 
SCHEMBL18554980 
CTK8C0266 
KS-00000BWI 
DTXSID10646736 
Literature
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