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1019012-13-5 | 5-Formyl-1-phenyl-1H-pyrazole-4-carboxylic acid methyl ester
CAS No: 1019012-13-5 Catalog No: AG01FGXH MDL No:
Product Description
Catalog Number:
AG01FGXH
Chemical Name:
5-Formyl-1-phenyl-1H-pyrazole-4-carboxylic acid methyl ester
CAS Number:
1019012-13-5
IUPAC Name:
methyl 5-formyl-1-phenylpyrazole-4-carboxylate
InChI:
InChI=1S/C12H10N2O3/c1-17-12(16)10-7-13-14(11(10)8-15)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
BOKKBTDWLJHRAX-UHFFFAOYSA-N
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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