Benzoic acid, 2-(hexahydro-1-methyl-1H-azepin-4-yl)hydrazide


Chemical Name: Benzoic acid, 2-(hexahydro-1-methyl-1H-azepin-4-yl)hydrazide
CAS Number: 110406-94-5
Product Number: AG009639(AGN-PC-0004RR)
Synonyms:
MDL No:
Molecular Formula: C14H21N3O
Molecular Weight: 247.3360

Identification/Properties


Computed Properties
Molecular Weight:
247.342g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
247.168g/mol
Monoisotopic Mass:
247.168g/mol
Topological Polar Surface Area:
44.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
264
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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