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128501-81-5

128501-81-5 | 4-METHOXY-3-MORPHOLIN-4-YLMETHYL-BENZALDEHYDE

CAS No: 128501-81-5 Catalog No: AG009BBY MDL No:MFCD00442737

Product Description

Catalog Number:
AG009BBY
Chemical Name:
4-METHOXY-3-MORPHOLIN-4-YLMETHYL-BENZALDEHYDE
CAS Number:
128501-81-5
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
MDL Number:
MFCD00442737
IUPAC Name:
4-methoxy-3-(morpholin-4-ylmethyl)benzaldehyde
InChI:
InChI=1S/C13H17NO3/c1-16-13-3-2-11(10-15)8-12(13)9-14-4-6-17-7-5-14/h2-3,8,10H,4-7,9H2,1H3
InChI Key:
YHRYKKIGMYJYLB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1CN1CCOCC1)C=O

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.283g/mol
Monoisotopic Mass:
235.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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