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189826-49-1 | Propanenitrile, 3-[bis(2,4,6-trimethylphenyl)phosphino]-
CAS No: 189826-49-1 Catalog No: AG002E14 MDL No:
Product Description
Catalog Number:
AG002E14
Chemical Name:
Propanenitrile, 3-[bis(2,4,6-trimethylphenyl)phosphino]-
CAS Number:
189826-49-1
Molecular Formula:
C21H26NP
Molecular Weight:
323.4116
IUPAC Name:
3-bis(2,4,6-trimethylphenyl)phosphanylpropanenitrile
InChI:
InChI=1S/C21H26NP/c1-14-10-16(3)20(17(4)11-14)23(9-7-8-22)21-18(5)12-15(2)13-19(21)6/h10-13H,7,9H2,1-6H3
InChI Key:
AOPRIALKQYJQAG-UHFFFAOYSA-N
SMILES:
N#CCCP(c1c(C)cc(cc1C)C)c1c(C)cc(cc1C)C
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.18g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.42g/mol
Monoisotopic Mass:
323.18g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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