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Home > Aldehydes > 1015845-56-3
1015845-56-3 | Benzaldehyde, 5-methoxy-2-(1H-pyrazol-1-yl)-
CAS No: 1015845-56-3 Catalog No: AG0004U9 MDL No:MFCD08059860
Product Description
Catalog Number:
AG0004U9
Chemical Name:
Benzaldehyde, 5-methoxy-2-(1H-pyrazol-1-yl)-
CAS Number:
1015845-56-3
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD08059860
IUPAC Name:
5-methoxy-2-pyrazol-1-ylbenzaldehyde
InChI:
InChI=1S/C11H10N2O2/c1-15-10-3-4-11(9(7-10)8-14)13-6-2-5-12-13/h2-8H,1H3
InChI Key:
WBOASTROTLWICF-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)ccc1n1cccn1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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