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Home > Aldehydes > 1934407-08-5
1934407-08-5 | 5-[3-hydroxy-3-(hydroxymethyl)pyrrolidin-1-yl]furan-2-carbaldehyde
CAS No: 1934407-08-5 Catalog No: AG01C8Y2 MDL No:MFCD31443435
Product Description
Catalog Number:
AG01C8Y2
Chemical Name:
5-[3-hydroxy-3-(hydroxymethyl)pyrrolidin-1-yl]furan-2-carbaldehyde
CAS Number:
1934407-08-5
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
MDL Number:
MFCD31443435
IUPAC Name:
5-[3-hydroxy-3-(hydroxymethyl)pyrrolidin-1-yl]furan-2-carbaldehyde
InChI:
InChI=1S/C10H13NO4/c12-5-8-1-2-9(15-8)11-4-3-10(14,6-11)7-13/h1-2,5,13-14H,3-4,6-7H2
InChI Key:
OWPQSMXVJHTQCE-UHFFFAOYSA-N
SMILES:
OCC1(O)CCN(C1)c1ccc(o1)C=O
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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