1H,3H-Pyrrolo[1,2-c][1,3,2]oxazaborole,tetrahydro-1-methyl-3,3-diphenyl-, (3aS)-


Chemical Name: 1H,3H-Pyrrolo[1,2-c][1,3,2]oxazaborole,tetrahydro-1-methyl-3,3-diphenyl-, (3aS)-
CAS Number: 112022-81-8
Product Number: AG00327O(AGN-PC-0P2VBF)
Synonyms:
MDL No:
Molecular Formula: C18H20BNO
Molecular Weight: 277.1685

Identification/Properties


Properties
MP:
115-117°C
BP:
111 °C
Storage:
Inert atmosphere;-10 ℃;
Form:
Liquid
Stability:
Air & Moisture Sensitive
Refractive Index:
-68 ° (C=1, MeOH)
Computed Properties
Molecular Weight:
277.174g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
277.164g/mol
Monoisotopic Mass:
277.164g/mol
Topological Polar Surface Area:
12.5A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
344
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
Danger
UN#:
1759
Hazard Statements:
H302-H318
Precautionary Statements:
P280-P301+P312+P330-P305+P351+P338+P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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