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113619-53-7 | 1-Propanol, 3-(diphenylphosphino)-2-methyl-
CAS No: 113619-53-7 Catalog No: AG000960 MDL No:
Product Description
Catalog Number:
AG000960
Chemical Name:
1-Propanol, 3-(diphenylphosphino)-2-methyl-
CAS Number:
113619-53-7
Molecular Formula:
C16H19OP
Molecular Weight:
258.2952
IUPAC Name:
3-diphenylphosphanyl-2-methylpropan-1-ol
InChI:
InChI=1S/C16H19OP/c1-14(12-17)13-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,14,17H,12-13H2,1H3
InChI Key:
GCFPLWLREOHCKX-UHFFFAOYSA-N
SMILES:
OCC(CP(c1ccccc1)c1ccccc1)C
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.117g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.301g/mol
Monoisotopic Mass:
258.117g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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