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Home > Aldehydes > 1694178-81-8
1694178-81-8 | 5-(3-hydroxy-3-methylpyrrolidin-1-yl)furan-2-carbaldehyde
CAS No: 1694178-81-8 Catalog No: AG01C8IH MDL No:MFCD31443129
Product Description
Catalog Number:
AG01C8IH
Chemical Name:
5-(3-hydroxy-3-methylpyrrolidin-1-yl)furan-2-carbaldehyde
CAS Number:
1694178-81-8
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD31443129
IUPAC Name:
5-(3-hydroxy-3-methylpyrrolidin-1-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C10H13NO3/c1-10(13)4-5-11(7-10)9-3-2-8(6-12)14-9/h2-3,6,13H,4-5,7H2,1H3
InChI Key:
TYRSHMIOKBHVID-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCC(C1)(C)O
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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