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89784-70-3

89784-70-3 | Phosphorous acid, 1-ethynylcyclohexyl diphenyl ester

CAS No: 89784-70-3 Catalog No: AG003YHL MDL No:

Product Description

Catalog Number:
AG003YHL
Chemical Name:
Phosphorous acid, 1-ethynylcyclohexyl diphenyl ester
CAS Number:
89784-70-3
Molecular Formula:
C20H21O3P
Molecular Weight:
340.3527
IUPAC Name:
(1-ethynylcyclohexyl) diphenyl phosphite
InChI:
InChI=1S/C20H21O3P/c1-2-20(16-10-5-11-17-20)23-24(21-18-12-6-3-7-13-18)22-19-14-8-4-9-15-19/h1,3-4,6-9,12-15H,5,10-11,16-17H2
InChI Key:
QZIQISGHQVBGKS-UHFFFAOYSA-N
SMILES:
C#CC1(CCCCC1)OP(Oc1ccccc1)Oc1ccccc1

Properties

Complexity:
392  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.123g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.359g/mol
Monoisotopic Mass:
340.123g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4  

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