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Home > Aldehydes > 1179758-89-4
1179758-89-4 | 4-(4-chloro-1H-pyrazol-1-yl)Benzaldehyde
CAS No: 1179758-89-4 Catalog No: AG003AHI MDL No:MFCD12822939
Product Description
Catalog Number:
AG003AHI
Chemical Name:
4-(4-chloro-1H-pyrazol-1-yl)Benzaldehyde
CAS Number:
1179758-89-4
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
MDL Number:
MFCD12822939
IUPAC Name:
4-(4-chloropyrazol-1-yl)benzaldehyde
InChI:
InChI=1S/C10H7ClN2O/c11-9-5-12-13(6-9)10-3-1-8(7-14)2-4-10/h1-7H
InChI Key:
QDBNQACVIQTGIN-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)n1ncc(c1)Cl
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.629g/mol
Monoisotopic Mass:
206.025g/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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