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Home > Aldehydes > 1860624-30-1
1860624-30-1 | 4-[3-(hydroxymethyl)thiomorpholin-4-yl]thiophene-2-carbaldehyde
CAS No: 1860624-30-1 Catalog No: AG01C8X6 MDL No:MFCD31443368
Product Description
Catalog Number:
AG01C8X6
Chemical Name:
4-[3-(hydroxymethyl)thiomorpholin-4-yl]thiophene-2-carbaldehyde
CAS Number:
1860624-30-1
Molecular Formula:
C10H13NO2S2
Molecular Weight:
243.3457
MDL Number:
MFCD31443368
IUPAC Name:
4-[3-(hydroxymethyl)thiomorpholin-4-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H13NO2S2/c12-4-9-6-14-2-1-11(9)8-3-10(5-13)15-7-8/h3,5,7,9,12H,1-2,4,6H2
InChI Key:
ZJVNKXFKQPZVQH-UHFFFAOYSA-N
SMILES:
OCC1CSCCN1c1csc(c1)C=O
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.039g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.339g/mol
Monoisotopic Mass:
243.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
94.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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