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Home > Aldehydes > 896141-21-2
896141-21-2 | 1,3-bis[(benzyloxy)methyl]-2-oxo-2,3-dihydro-1H-imidazole-4-carbaldehyde
CAS No: 896141-21-2 Catalog No: AG01BV3X MDL No:MFCD30476247
Product Description
Catalog Number:
AG01BV3X
Chemical Name:
1,3-bis[(benzyloxy)methyl]-2-oxo-2,3-dihydro-1H-imidazole-4-carbaldehyde
CAS Number:
896141-21-2
Molecular Formula:
C20H20N2O4
Molecular Weight:
352.3838
MDL Number:
MFCD30476247
IUPAC Name:
2-oxo-1,3-bis(phenylmethoxymethyl)imidazole-4-carbaldehyde
InChI:
InChI=1S/C20H20N2O4/c23-12-19-11-21(15-25-13-17-7-3-1-4-8-17)20(24)22(19)16-26-14-18-9-5-2-6-10-18/h1-12H,13-16H2
InChI Key:
RSZJXJSELROYTE-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c(=O)n1COCc1ccccc1)COCc1ccccc1
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.39g/mol
Monoisotopic Mass:
352.142g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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