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Home > Aldehydes > 1098004-79-5
1098004-79-5 | 1-(3-pyridinyl)- 1H-pyrazole-4-carbaldehyde
CAS No: 1098004-79-5 Catalog No: AG0095HL MDL No:MFCD18838744
Product Description
Catalog Number:
AG0095HL
Chemical Name:
1-(3-pyridinyl)- 1H-pyrazole-4-carbaldehyde
CAS Number:
1098004-79-5
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
MDL Number:
MFCD18838744
IUPAC Name:
1-pyridin-3-ylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C9H7N3O/c13-7-8-4-11-12(6-8)9-2-1-3-10-5-9/h1-7H
InChI Key:
WFVPWRGLCLBLNE-UHFFFAOYSA-N
SMILES:
O=Cc1cnn(c1)c1cccnc1
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.175g/mol
Monoisotopic Mass:
173.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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