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Home > Aldehydes > 1355237-68-1
1355237-68-1 | 5-Methyl-6-(piperazin-1-yl)nicotinaldehyde
CAS No: 1355237-68-1 Catalog No: AG00AASQ MDL No:MFCD21087648
Product Description
Catalog Number:
AG00AASQ
Chemical Name:
5-Methyl-6-(piperazin-1-yl)nicotinaldehyde
CAS Number:
1355237-68-1
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
MDL Number:
MFCD21087648
IUPAC Name:
5-methyl-6-piperazin-1-ylpyridine-3-carbaldehyde
InChI:
InChI=1S/C11H15N3O/c1-9-6-10(8-15)7-13-11(9)14-4-2-12-3-5-14/h6-8,12H,2-5H2,1H3
InChI Key:
BQIVODLVMWDRNL-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(c(c1)C)N1CCNCC1
Properties
Complexity:
216
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:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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