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865156-81-6

865156-81-6 | 6-Bromo-1-(3-methoxypropyl)-3-methyl-1H-Indazole

CAS No: 865156-81-6 Catalog No: AG004M0D MDL No:MFCD11110650

Product Description

Catalog Number:
AG004M0D
Chemical Name:
6-Bromo-1-(3-methoxypropyl)-3-methyl-1H-Indazole
CAS Number:
865156-81-6
Molecular Formula:
C12H15BrN2O
Molecular Weight:
283.1643
MDL Number:
MFCD11110650
IUPAC Name:
6-bromo-1-(3-methoxypropyl)-3-methylindazole
InChI:
InChI=1S/C12H15BrN2O/c1-9-11-5-4-10(13)8-12(11)15(14-9)6-3-7-16-2/h4-5,8H,3,6-7H2,1-2H3
InChI Key:
ZYIYWLFVGBFSJC-UHFFFAOYSA-N
SMILES:
Cc1nn(c2c1ccc(c2)Br)CCCOC

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.037g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.169g/mol
Monoisotopic Mass:
282.037g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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