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Home > Aldehydes > 1342231-49-5
1342231-49-5 | 5-(1,4-OXAZEPAN-4-YL)FURAN-2-CARBALDEHYDE
CAS No: 1342231-49-5 Catalog No: AG01C8IL MDL No:MFCD17261823
Product Description
Catalog Number:
AG01C8IL
Chemical Name:
5-(1,4-OXAZEPAN-4-YL)FURAN-2-CARBALDEHYDE
CAS Number:
1342231-49-5
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD17261823
IUPAC Name:
5-(1,4-oxazepan-4-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C10H13NO3/c12-8-9-2-3-10(14-9)11-4-1-6-13-7-5-11/h2-3,8H,1,4-7H2
InChI Key:
IMKFRYVJZYOAGU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCOCCC1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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