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89841-26-9

89841-26-9 | 1-Butanol, 2-(diphenylphosphinyl)-, acetate

CAS No: 89841-26-9 Catalog No: AG003XH4 MDL No:

Product Description

Catalog Number:
AG003XH4
Chemical Name:
1-Butanol, 2-(diphenylphosphinyl)-, acetate
CAS Number:
89841-26-9
Molecular Formula:
C18H23O4P
Molecular Weight:
334.3466
IUPAC Name:
acetic acid;2-diphenylphosphorylbutan-1-ol
InChI:
InChI=1S/C16H19O2P.C2H4O2/c1-2-14(13-17)19(18,15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-2(3)4/h3-12,14,17H,2,13H2,1H3;1H3,(H,3,4)
InChI Key:
BMZVYOPYICVOOH-UHFFFAOYSA-N
SMILES:
CC(=O)O.CCC(P(=O)(c1ccccc1)c1ccccc1)CO

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.133g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
334.352g/mol
Monoisotopic Mass:
334.133g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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