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Home > Aldehydes > 1152503-90-6
1152503-90-6 | 3-(2-BROMOPHENYL)-1-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
CAS No: 1152503-90-6 Catalog No: AG01DV00 MDL No:MFCD11180169
Product Description
Catalog Number:
AG01DV00
Chemical Name:
3-(2-BROMOPHENYL)-1-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
CAS Number:
1152503-90-6
Molecular Formula:
C11H9BrN2O
Molecular Weight:
265.1060
MDL Number:
MFCD11180169
IUPAC Name:
3-(2-bromophenyl)-1-methylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C11H9BrN2O/c1-14-6-8(7-15)11(13-14)9-4-2-3-5-10(9)12/h2-7H,1H3
InChI Key:
IAIPUZKMELNZPH-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1ccccc1Br)C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.99g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.11g/mol
Monoisotopic Mass:
263.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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