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4-propoxyazepane

CAS No.:
1269151-10-1
Catalog Number:
AG01AGRV
Molecular Formula:
C9H19NO
Molecular Weight:
157.2533
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Product Description
Catalog Number:
AG01AGRV
Chemical Name:
4-propoxyazepane
CAS Number:
1269151-10-1
Molecular Formula:
C9H19NO
Molecular Weight:
157.2533
MDL Number:
MFCD18380635
IUPAC Name:
4-propoxyazepane
InChI:
InChI=1S/C9H19NO/c1-2-8-11-9-4-3-6-10-7-5-9/h9-10H,2-8H2,1H3
InChI Key:
QBTPBTNBMUKZBB-UHFFFAOYSA-N
SMILES:
CCCOC1CCNCCC1
Properties
Complexity:
95.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.147g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.257g/mol
Monoisotopic Mass:
157.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties