1H-Azepine, hexahydro-2-phenyl-


Chemical Name: 1H-Azepine, hexahydro-2-phenyl-
CAS Number: 3466-82-8
Product Number: AG00BYMT(AGN-PC-0LAYPW)
Synonyms:
MDL No:
Molecular Formula: C12H17N
Molecular Weight: 175.2701

Identification/Properties


Properties
BP:
276.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
175.275g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
175.136g/mol
Monoisotopic Mass:
175.136g/mol
Topological Polar Surface Area:
12A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
138
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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