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Home > Aldehydes > 1600624-31-4
1600624-31-4 | 1,3-dimethyl-5-(1,2,3,6-tetrahydropyridin-1-yl)-1H-pyrazole-4-carbaldehyde
CAS No: 1600624-31-4 Catalog No: AG01C8NX MDL No:
Product Description
Catalog Number:
AG01C8NX
Chemical Name:
1,3-dimethyl-5-(1,2,3,6-tetrahydropyridin-1-yl)-1H-pyrazole-4-carbaldehyde
CAS Number:
1600624-31-4
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
IUPAC Name:
5-(3,6-dihydro-2H-pyridin-1-yl)-1,3-dimethylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C11H15N3O/c1-9-10(8-15)11(13(2)12-9)14-6-4-3-5-7-14/h3-4,8H,5-7H2,1-2H3
InChI Key:
BMGUPIJNNHDJIH-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)nn(c1N1CCC=CC1)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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