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Home > Aldehydes > 1423028-05-0
1423028-05-0 | 1-(2-chloro-4-fluorophenyl)-1H-1,2,3-triazole-4-carbaldehyde
CAS No: 1423028-05-0 Catalog No: AG01A2O3 MDL No:MFCD21715531
Product Description
Catalog Number:
AG01A2O3
Chemical Name:
1-(2-chloro-4-fluorophenyl)-1H-1,2,3-triazole-4-carbaldehyde
CAS Number:
1423028-05-0
Molecular Formula:
C9H5ClFN3O
Molecular Weight:
225.6069
MDL Number:
MFCD21715531
IUPAC Name:
1-(2-chloro-4-fluorophenyl)triazole-4-carbaldehyde
InChI:
InChI=1S/C9H5ClFN3O/c10-8-3-6(11)1-2-9(8)14-4-7(5-15)12-13-14/h1-5H
InChI Key:
JVDHJIKMBSAUFG-UHFFFAOYSA-N
SMILES:
O=Cc1nnn(c1)c1ccc(cc1Cl)F
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.011g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.607g/mol
Monoisotopic Mass:
225.011g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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