2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-ol


Chemical Name: 2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-ol
CAS Number: 886366-76-3
Product Number: AG004AEM(AGN-PC-051MA6)
Synonyms:
MDL No:
Molecular Formula: C9H12N2O
Molecular Weight: 164.2044

Identification/Properties


Properties
BP:
374.6 °C at 760 mmHg
Computed Properties
Molecular Weight:
164.208g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
164.095g/mol
Monoisotopic Mass:
164.095g/mol
Topological Polar Surface Area:
44.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
152
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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