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1692652-07-5

1692652-07-5 | 2-(1,4-oxazepan-4-yl)pyridine-3-carbaldehyde

CAS No: 1692652-07-5 Catalog No: AG01C8PY MDL No:MFCD29966434

Product Description

Catalog Number:
AG01C8PY
Chemical Name:
2-(1,4-oxazepan-4-yl)pyridine-3-carbaldehyde
CAS Number:
1692652-07-5
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD29966434
IUPAC Name:
2-(1,4-oxazepan-4-yl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C11H14N2O2/c14-9-10-3-1-4-12-11(10)13-5-2-7-15-8-6-13/h1,3-4,9H,2,5-8H2
InChI Key:
LDOFBKMSKNTVMH-UHFFFAOYSA-N
SMILES:
O=Cc1cccnc1N1CCOCCC1

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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