Home Other Building Blocks 1-propyl-1,4-diazepan-2-one

1-propyl-1,4-diazepan-2-one

CAS No.:
155595-81-6
Catalog Number:
AG01AFJT
Molecular Formula:
C8H16N2O
Molecular Weight:
156.2254
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Product Description
Catalog Number:
AG01AFJT
Chemical Name:
1-propyl-1,4-diazepan-2-one
CAS Number:
155595-81-6
Molecular Formula:
C8H16N2O
Molecular Weight:
156.2254
MDL Number:
MFCD21195066
IUPAC Name:
1-propyl-1,4-diazepan-2-one
InChI:
InChI=1S/C8H16N2O/c1-2-5-10-6-3-4-9-7-8(10)11/h9H,2-7H2,1H3
InChI Key:
ONMRUIGEYUMICY-UHFFFAOYSA-N
SMILES:
CCCN1CCCNCC1=O
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.126g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.229g/mol
Monoisotopic Mass:
156.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties