11269872
  -OEChem-04232423032D

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    4.2704   -2.5124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4480    0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1212    1.5727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7901   -0.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0908    1.2254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1364    1.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7640    2.3388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7749   -0.6540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3118   -0.9640    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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    9.0756    1.6718    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3959    3.1610    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2575    2.3761    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0326    3.3861    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4220    3.8984    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8162   -0.3629    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9546    0.4221    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6492    4.0347    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <PUBCHEM_COMPOUND_CID>
11269872

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
441

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
6

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcfB4MAIAAAAAAAAAAAAAAAAAAAAAAAAwYMGAAAAAAAABQAAAGggAAAAADASImAIyBoAABCCAAiBCAAACCAAgIAAIiAAGCIgMJyKEMRqAMCAlwBUIqAeA4OwOgAAACAAIAAAAAAAQABAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane

> <PUBCHEM_IUPAC_CAS_NAME>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphine

> <PUBCHEM_IUPAC_NAME_MARKUP>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane

> <PUBCHEM_IUPAC_NAME>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphane

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
dicyclohexyl-[2-(2,6-dimethoxyphenyl)phenyl]phosphine

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C26H35O2P/c1-27-23-17-11-18-24(28-2)26(23)22-16-9-10-19-25(22)29(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h9-11,16-21H,3-8,12-15H2,1-2H3

> <PUBCHEM_IUPAC_INCHIKEY>
VNFWTIYUKDMAOP-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
6.7

> <PUBCHEM_EXACT_MASS>
410.23746735

> <PUBCHEM_MOLECULAR_FORMULA>
C26H35O2P

> <PUBCHEM_MOLECULAR_WEIGHT>
410.5

> <PUBCHEM_OPENEYE_CAN_SMILES>
COC1=C(C(=CC=C1)OC)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4

> <PUBCHEM_OPENEYE_ISO_SMILES>
COC1=C(C(=CC=C1)OC)C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4

> <PUBCHEM_CACTVS_TPSA>
18.5

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
410.23746735

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
29

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
16  17  8
16  18  8
17  20  8
18  21  8
19  23  8
19  24  8
20  22  8
21  22  8
23  25  8
24  26  8
25  27  8
26  27  8

$$$$