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(5-{6-[bis(4-methylphenyl)phosphanyl]-2,3-dihydro-1,4-benzodioxin-5-yl}-2,3-dihydro-1,4-benzodioxin-6-yl)bis(4-methylphenyl)phosphane

(5-{6-[bis(4-methylphenyl)phosphanyl]-2,3-dihydro-1,4-benzodioxin-5-yl}-2,3-dihydro-1,4-benzodioxin-6-yl)bis(4-methylphenyl)phosphane

Formula: C44H40O4P2

SMILES: CC1=CC=C(C=C1)P(C1=CC=C(C)C=C1)C1=C(C2=C(OCCO2)C=C1)C1=C(C=CC2=C1OCCO2)P(C1=CC=C(C)C=C1)C1=CC=C(C)C=C1

IUPAC: (5-{6-[bis(4-methylphenyl)phosphanyl]-2,3-dihydro-1,4-benzodioxin-5-yl}-2,3-dihydro-1,4-benzodioxin-6-yl)bis(4-methylphenyl)phosphane

InChI: InChI=1S/C44H40O4P2/c1-29-5-13-33(14-6-29)49(34-15-7-30(2)8-16-34)39-23-21-37-43(47-27-25-45-37)41(39)42-40(24-22-38-44(42)48-28-26-46-38)50(35-17-9-31(3)10-18-35)36-19-11-32(4)12-20-36/h5-24H,25-28H2,1-4H3

Composition: C (76.07%), H (5.80%), O (9.21%), P (8.92%)

Molar Mass: 694.748

Atom Count: 90

Heavy Atom Count: 50

Properties
Properties
Common Names N/A
Aromatic Ring Count 6
Asymmetric Atom Count 0
Exact Mass 694.240183764
Formal Charge 0
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey ZAFQLNWLOAQQLW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 204.4
Topological Polar Surface Area 36.92
Polarizability 80.83
Ring Count 8
Rotatable Bond Count 6

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Purity (%)
-
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Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C44H40O4P2 Quote Only