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158918-42-4

158918-42-4 | Hexanenitrile, 6,6',6''-borylidynetris-

CAS No: 158918-42-4 Catalog No: AG001R0J MDL No:

Product Description

Catalog Number:
AG001R0J
Chemical Name:
Hexanenitrile, 6,6',6''-borylidynetris-
CAS Number:
158918-42-4
Molecular Formula:
C18H30BN3
Molecular Weight:
299.2619
IUPAC Name:
6-[bis(5-cyanopentyl)boranyl]hexanenitrile
InChI:
InChI=1S/C18H30BN3/c20-16-10-4-1-7-13-19(14-8-2-5-11-17-21)15-9-3-6-12-18-22/h1-15H2
InChI Key:
CNOWDUBONGVNDD-UHFFFAOYSA-N
SMILES:
N#CCCCCCB(CCCCCC#N)CCCCCC#N

Properties

Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.253g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.269g/mol
Monoisotopic Mass:
299.253g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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