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Home > Aldehydes > 1852419-94-3
1852419-94-3 | 4-(3-methoxy-3-methylpyrrolidin-1-yl)thiophene-2-carbaldehyde
CAS No: 1852419-94-3 Catalog No: AG01C8RD MDL No:MFCD31443216
Product Description
Catalog Number:
AG01C8RD
Chemical Name:
4-(3-methoxy-3-methylpyrrolidin-1-yl)thiophene-2-carbaldehyde
CAS Number:
1852419-94-3
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD31443216
IUPAC Name:
4-(3-methoxy-3-methylpyrrolidin-1-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C11H15NO2S/c1-11(14-2)3-4-12(8-11)9-5-10(6-13)15-7-9/h5-7H,3-4,8H2,1-2H3
InChI Key:
KKQGOWOIFQEVIU-UHFFFAOYSA-N
SMILES:
COC1(C)CCN(C1)c1csc(c1)C=O
Properties
Complexity:
249
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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