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850363-68-7

850363-68-7 | 5-Bromo-4-ethoxy-1H-indazole

CAS No: 850363-68-7 Catalog No: AG004ZV2 MDL No:MFCD13177023

Product Description

Catalog Number:
AG004ZV2
Chemical Name:
5-Bromo-4-ethoxy-1H-indazole
CAS Number:
850363-68-7
Molecular Formula:
C9H9BrN2O
Molecular Weight:
241.0846
MDL Number:
MFCD13177023
IUPAC Name:
5-bromo-4-ethoxy-1H-indazole
InChI:
InChI=1S/C9H9BrN2O/c1-2-13-9-6-5-11-12-8(6)4-3-7(9)10/h3-5H,2H2,1H3,(H,11,12)
InChI Key:
NMZYANUDQSAWMB-UHFFFAOYSA-N
SMILES:
CCOc1c(Br)ccc2c1cn[nH]2

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.99g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.088g/mol
Monoisotopic Mass:
239.99g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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