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Home > Aldehydes > 1702431-19-3
1702431-19-3 | 6-(3,4-dihydroxypyrrolidin-1-yl)pyridine-3-carbaldehyde
CAS No: 1702431-19-3 Catalog No: AG01C8L3 MDL No:MFCD31443151
Product Description
Catalog Number:
AG01C8L3
Chemical Name:
6-(3,4-dihydroxypyrrolidin-1-yl)pyridine-3-carbaldehyde
CAS Number:
1702431-19-3
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD31443151
IUPAC Name:
6-(3,4-dihydroxypyrrolidin-1-yl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C10H12N2O3/c13-6-7-1-2-10(11-3-7)12-4-8(14)9(15)5-12/h1-3,6,8-9,14-15H,4-5H2
InChI Key:
VCJCIFSSDUIQMI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nc1)N1CC(C(C1)O)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:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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