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Home > Aldehydes > 1269294-19-0
1269294-19-0 | 1H-Pyrazole-5-carboxaldehyde, 1-(2-bromophenyl)-
CAS No: 1269294-19-0 Catalog No: AG000WET MDL No:MFCD20275388
Product Description
Catalog Number:
AG000WET
Chemical Name:
1H-Pyrazole-5-carboxaldehyde, 1-(2-bromophenyl)-
CAS Number:
1269294-19-0
Molecular Formula:
C10H7BrN2O
Molecular Weight:
251.0794
MDL Number:
MFCD20275388
IUPAC Name:
2-(2-bromophenyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C10H7BrN2O/c11-9-3-1-2-4-10(9)13-8(7-14)5-6-12-13/h1-7H
InChI Key:
QUCOOKYGFWBXFX-UHFFFAOYSA-N
SMILES:
O=Cc1ccnn1c1ccccc1Br
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.083g/mol
Monoisotopic Mass:
249.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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