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1566359-87-2 | 4-[2-(HYDROXYMETHYL)MORPHOLIN-4-YL]THIOPHENE-2-CARBALDEHYDE
CAS No: 1566359-87-2 Catalog No: AG01C8RK MDL No:MFCD26866540
Product Description
Catalog Number:
AG01C8RK
Chemical Name:
4-[2-(HYDROXYMETHYL)MORPHOLIN-4-YL]THIOPHENE-2-CARBALDEHYDE
CAS Number:
1566359-87-2
Molecular Formula:
C10H13NO3S
Molecular Weight:
227.2801
MDL Number:
MFCD26866540
IUPAC Name:
4-[2-(hydroxymethyl)morpholin-4-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H13NO3S/c12-5-9-4-11(1-2-14-9)8-3-10(6-13)15-7-8/h3,6-7,9,12H,1-2,4-5H2
InChI Key:
TYQPRPZRAACFIX-UHFFFAOYSA-N
SMILES:
OCC1OCCN(C1)c1csc(c1)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:
0.5
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