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Home > Aldehydes > 1251023-52-5
1251023-52-5 | 2H-Indazole-3-carboxaldehyde, 5-bromo-2-methyl-
CAS No: 1251023-52-5 Catalog No: AG000N77 MDL No:MFCD11520882
Product Description
Catalog Number:
AG000N77
Chemical Name:
2H-Indazole-3-carboxaldehyde, 5-bromo-2-methyl-
CAS Number:
1251023-52-5
Molecular Formula:
C9H7BrN2O
Molecular Weight:
239.0687
MDL Number:
MFCD11520882
IUPAC Name:
5-bromo-2-methylindazole-3-carbaldehyde
InChI:
InChI=1S/C9H7BrN2O/c1-12-9(5-13)7-4-6(10)2-3-8(7)11-12/h2-5H,1H3
InChI Key:
LCFUFGSPCPOBCI-UHFFFAOYSA-N
SMILES:
Cn1nc2c(c1C=O)cc(cc2)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:
0
Isotope Atom Count:
0
Molecular Weight:
239.072g/mol
Monoisotopic Mass:
237.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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