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Home > Aldehydes > 1339518-61-4
1339518-61-4 | 5-(2-METHYL-1,4-OXAZEPAN-4-YL)FURAN-2-CARBALDEHYDE
CAS No: 1339518-61-4 Catalog No: AG01C8KL MDL No:MFCD17261815
Product Description
Catalog Number:
AG01C8KL
Chemical Name:
5-(2-METHYL-1,4-OXAZEPAN-4-YL)FURAN-2-CARBALDEHYDE
CAS Number:
1339518-61-4
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
MDL Number:
MFCD17261815
IUPAC Name:
5-(2-methyl-1,4-oxazepan-4-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H15NO3/c1-9-7-12(5-2-6-14-9)11-4-3-10(8-13)15-11/h3-4,8-9H,2,5-7H2,1H3
InChI Key:
BMOMVJMJHOEZHX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCCOC(C1)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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