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1540878-14-5 | 5-[2-(HYDROXYMETHYL)MORPHOLIN-4-YL]THIOPHENE-2-CARBALDEHYDE
CAS No: 1540878-14-5 Catalog No: AG01C8NC MDL No:MFCD24068613
Product Description
Catalog Number:
AG01C8NC
Chemical Name:
5-[2-(HYDROXYMETHYL)MORPHOLIN-4-YL]THIOPHENE-2-CARBALDEHYDE
CAS Number:
1540878-14-5
Molecular Formula:
C10H13NO3S
Molecular Weight:
227.2801
MDL Number:
MFCD24068613
IUPAC Name:
5-[2-(hydroxymethyl)morpholin-4-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H13NO3S/c12-6-8-5-11(3-4-14-8)10-2-1-9(7-13)15-10/h1-2,7-8,12H,3-6H2
InChI Key:
OWSAENGGZMADBW-UHFFFAOYSA-N
SMILES:
OCC1OCCN(C1)c1ccc(s1)C=O
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.062g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.278g/mol
Monoisotopic Mass:
227.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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