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1851134-70-7 | 5-[3-(hydroxymethyl)-3-methylpyrrolidin-1-yl]furan-2-carbaldehyde
CAS No: 1851134-70-7 Catalog No: AG01C8H8 MDL No:MFCD31443108
Product Description
Catalog Number:
AG01C8H8
Chemical Name:
5-[3-(hydroxymethyl)-3-methylpyrrolidin-1-yl]furan-2-carbaldehyde
CAS Number:
1851134-70-7
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
MDL Number:
MFCD31443108
IUPAC Name:
5-[3-(hydroxymethyl)-3-methylpyrrolidin-1-yl]furan-2-carbaldehyde
InChI:
InChI=1S/C11H15NO3/c1-11(8-14)4-5-12(7-11)10-3-2-9(6-13)15-10/h2-3,6,14H,4-5,7-8H2,1H3
InChI Key:
WEPFBCJFNHREQR-UHFFFAOYSA-N
SMILES:
OCC1(C)CCN(C1)c1ccc(o1)C=O
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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