Home Other Building Blocks 1-acetyl-1,4-diazepan-5-one

1-acetyl-1,4-diazepan-5-one

CAS No.:
1343572-05-3
Catalog Number:
AG01A2CX
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
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Product Description
Catalog Number:
AG01A2CX
Chemical Name:
1-acetyl-1,4-diazepan-5-one
CAS Number:
1343572-05-3
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
MDL Number:
MFCD17258120
IUPAC Name:
1-acetyl-1,4-diazepan-5-one
InChI:
InChI=1S/C7H12N2O2/c1-6(10)9-4-2-7(11)8-3-5-9/h2-5H2,1H3,(H,8,11)
InChI Key:
VBHHQCFPKDZJGQ-UHFFFAOYSA-N
SMILES:
O=C1NCCN(CC1)C(=O)C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.09g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.185g/mol
Monoisotopic Mass:
156.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties