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Home > Aldehydes > 1339878-21-5
1339878-21-5 | 5-[METHYL(OXAN-4-YL)AMINO]THIOPHENE-2-CARBALDEHYDE
CAS No: 1339878-21-5 Catalog No: AG01C8N9 MDL No:MFCD20300241
Product Description
Catalog Number:
AG01C8N9
Chemical Name:
5-[METHYL(OXAN-4-YL)AMINO]THIOPHENE-2-CARBALDEHYDE
CAS Number:
1339878-21-5
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD20300241
IUPAC Name:
5-[methyl(oxan-4-yl)amino]thiophene-2-carbaldehyde
InChI:
InChI=1S/C11H15NO2S/c1-12(9-4-6-14-7-5-9)11-3-2-10(8-13)15-11/h2-3,8-9H,4-7H2,1H3
InChI Key:
VAHRBKAXAPTWCI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)N(C1CCOCC1)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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