1,1'-Biphenyl, isocyanato-


Chemical Name: 1,1'-Biphenyl, isocyanato-
CAS Number: 17337-13-2
Product Number: AG001YUZ(AGN-PC-0JNBGM)
Synonyms:
MDL No:
Molecular Formula: C13H9NO
Molecular Weight: 195.2167

Identification/Properties


Properties
BP:
320.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.606(lit.)
Computed Properties
Molecular Weight:
195.221g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
195.068g/mol
Monoisotopic Mass:
195.068g/mol
Topological Polar Surface Area:
29.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
239
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:
Danger
UN#:
2811
Hazard Statements:
H301+H331-H315-H319-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P332+P313+P362+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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