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1565719-21-2

1565719-21-2 | 4-[3-(HYDROXYMETHYL)PYRROLIDIN-1-YL]BENZALDEHYDE

CAS No: 1565719-21-2 Catalog No: AG01C8MI MDL No:MFCD26060537

Product Description

Catalog Number:
AG01C8MI
Chemical Name:
4-[3-(HYDROXYMETHYL)PYRROLIDIN-1-YL]BENZALDEHYDE
CAS Number:
1565719-21-2
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD26060537
IUPAC Name:
4-[3-(hydroxymethyl)pyrrolidin-1-yl]benzaldehyde
InChI:
InChI=1S/C12H15NO2/c14-8-10-1-3-12(4-2-10)13-6-5-11(7-13)9-15/h1-4,8,11,15H,5-7,9H2
InChI Key:
FZTAWFYSULHSCL-UHFFFAOYSA-N
SMILES:
OCC1CCN(C1)c1ccc(cc1)C=O

Properties

Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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