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89214-00-6 | Phosphonium, [2-(methylphenylamino)ethyl]triphenyl-
CAS No: 89214-00-6 Catalog No: AG00463U MDL No:
Product Description
Catalog Number:
AG00463U
Chemical Name:
Phosphonium, [2-(methylphenylamino)ethyl]triphenyl-
CAS Number:
89214-00-6
Molecular Formula:
C27H27NP+
Molecular Weight:
396.4837
IUPAC Name:
2-(N-methylanilino)ethyl-triphenylphosphanium
InChI:
InChI=1S/C27H27NP/c1-28(24-14-6-2-7-15-24)22-23-29(25-16-8-3-9-17-25,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21H,22-23H2,1H3/q+1
InChI Key:
OBMIULBSSGOIKW-UHFFFAOYSA-N
SMILES:
CN(c1ccccc1)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.188g/mol
Formal Charge:
1
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.494g/mol
Monoisotopic Mass:
396.188g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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