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1000340-73-7

1000340-73-7 | 1H-Indazole-3-carboxaldehyde, 6-bromo-7-methyl-

CAS No: 1000340-73-7 Catalog No: AG0000EB MDL No:

Product Description

Catalog Number:
AG0000EB
Chemical Name:
1H-Indazole-3-carboxaldehyde, 6-bromo-7-methyl-
CAS Number:
1000340-73-7
Molecular Formula:
C9H7BrN2O
Molecular Weight:
239.0687
IUPAC Name:
6-bromo-7-methyl-2H-indazole-3-carbaldehyde
InChI:
InChI=1S/C9H7BrN2O/c1-5-7(10)3-2-6-8(4-13)11-12-9(5)6/h2-4H,1H3,(H,11,12)
InChI Key:
IBWRVJFENOQITQ-UHFFFAOYSA-N
SMILES:
O=Cc1n[nH]c2c1ccc(c2C)Br

Properties

Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.072g/mol
Monoisotopic Mass:
237.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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