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1339156-28-3 | 3-FLUORO-4-(3-HYDROXYPYRROLIDIN-1-YL)BENZALDEHYDE
CAS No: 1339156-28-3 Catalog No: AG01C8LR MDL No:MFCD17249352
Product Description
Catalog Number:
AG01C8LR
Chemical Name:
3-FLUORO-4-(3-HYDROXYPYRROLIDIN-1-YL)BENZALDEHYDE
CAS Number:
1339156-28-3
Molecular Formula:
C11H12FNO2
Molecular Weight:
209.2169
MDL Number:
MFCD17249352
IUPAC Name:
3-fluoro-4-(3-hydroxypyrrolidin-1-yl)benzaldehyde
InChI:
InChI=1S/C11H12FNO2/c12-10-5-8(7-14)1-2-11(10)13-4-3-9(15)6-13/h1-2,5,7,9,15H,3-4,6H2
InChI Key:
UGEOEVZVWWNWIR-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)N1CCC(C1)O
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.22g/mol
Monoisotopic Mass:
209.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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