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1869794-13-7 | 5-(4-hydroxyazepan-1-yl)furan-2-carbaldehyde
CAS No: 1869794-13-7 Catalog No: AG01C8SQ MDL No:MFCD29491630
Product Description
Catalog Number:
AG01C8SQ
Chemical Name:
5-(4-hydroxyazepan-1-yl)furan-2-carbaldehyde
CAS Number:
1869794-13-7
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
MDL Number:
MFCD29491630
IUPAC Name:
5-(4-hydroxyazepan-1-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H15NO3/c13-8-10-3-4-11(15-10)12-6-1-2-9(14)5-7-12/h3-4,8-9,14H,1-2,5-7H2
InChI Key:
UJPBLTOHSPWMCW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CCCC(CC1)O
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:
1
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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