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Home > Aldehydes > 1699059-88-5
1699059-88-5 | 2-(thiomorpholin-4-yl)pyridine-3-carbaldehyde
CAS No: 1699059-88-5 Catalog No: AG01C8PM MDL No:MFCD31443196
Product Description
Catalog Number:
AG01C8PM
Chemical Name:
2-(thiomorpholin-4-yl)pyridine-3-carbaldehyde
CAS Number:
1699059-88-5
Molecular Formula:
C10H12N2OS
Molecular Weight:
208.2801
MDL Number:
MFCD31443196
IUPAC Name:
2-thiomorpholin-4-ylpyridine-3-carbaldehyde
InChI:
InChI=1S/C10H12N2OS/c13-8-9-2-1-3-11-10(9)12-4-6-14-7-5-12/h1-3,8H,4-7H2
InChI Key:
HNGBGISZHSNDHP-UHFFFAOYSA-N
SMILES:
O=Cc1cccnc1N1CCSCC1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.279g/mol
Monoisotopic Mass:
208.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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