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1936283-68-9

1936283-68-9 | 5-(6-hydroxy-1,4-oxazepan-4-yl)furan-2-carbaldehyde

CAS No: 1936283-68-9 Catalog No: AG01C8YJ MDL No:MFCD31443448

Product Description

Catalog Number:
AG01C8YJ
Chemical Name:
5-(6-hydroxy-1,4-oxazepan-4-yl)furan-2-carbaldehyde
CAS Number:
1936283-68-9
Molecular Formula:
C10H13NO4
Molecular Weight:
211.2145
MDL Number:
MFCD31443448
IUPAC Name:
5-(6-hydroxy-1,4-oxazepan-4-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C10H13NO4/c12-6-9-1-2-10(15-9)11-3-4-14-7-8(13)5-11/h1-2,6,8,13H,3-5,7H2
InChI Key:
QBUVTXYMBHMOGP-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCOCC(C1)O

Properties

Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.084g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.217g/mol
Monoisotopic Mass:
211.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

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