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1600-49-3

1600-49-3 | Benzene, 1,1',1''-(isocyanomethylidyne)tris-

CAS No: 1600-49-3 Catalog No: AG001RL7 MDL No:

Product Description

Catalog Number:
AG001RL7
Chemical Name:
Benzene, 1,1',1''-(isocyanomethylidyne)tris-
CAS Number:
1600-49-3
Molecular Formula:
C20H15N
Molecular Weight:
269.3398
IUPAC Name:
[isocyano(diphenyl)methyl]benzene
InChI:
InChI=1S/C20H15N/c1-21-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H
InChI Key:
CYIILORDDHWQLQ-UHFFFAOYSA-N
SMILES:
[C-]#[N+]C(c1ccccc1)(c1ccccc1)c1ccccc1

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.12g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.347g/mol
Monoisotopic Mass:
269.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
4.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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