1H-1,4-Diazepine, 1-acetylhexahydro-


Chemical Name: 1H-1,4-Diazepine, 1-acetylhexahydro-
CAS Number: 61903-11-5
Product Number: AG003SOZ(AGN-PC-0L6UI1)
Synonyms:
MDL No:
Molecular Formula: C7H14N2O
Molecular Weight: 142.1989

Identification/Properties


Properties
BP:
274.5°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
142.202g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
142.111g/mol
Monoisotopic Mass:
142.111g/mol
Topological Polar Surface Area:
32.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
125
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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