Home Halogens 3-chloro-4-(4-methyl-1H-pyrazol-1-yl)benzaldehyde

3-chloro-4-(4-methyl-1H-pyrazol-1-yl)benzaldehyde

CAS No.:
1541538-18-4
Catalog Number:
AG01DVL4
Molecular Formula:
C11H9ClN2O
Molecular Weight:
220.6550
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Product Description
Catalog Number:
AG01DVL4
Chemical Name:
3-chloro-4-(4-methyl-1H-pyrazol-1-yl)benzaldehyde
CAS Number:
1541538-18-4
Molecular Formula:
C11H9ClN2O
Molecular Weight:
220.6550
MDL Number:
MFCD24056300
IUPAC Name:
3-chloro-4-(4-methylpyrazol-1-yl)benzaldehyde
InChI:
InChI=1S/C11H9ClN2O/c1-8-5-13-14(6-8)11-3-2-9(7-15)4-10(11)12/h2-7H,1H3
InChI Key:
SQEQJUCOCCOUEZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Cl)n1ncc(c1)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:
220.04g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.656g/mol
Monoisotopic Mass:
220.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties