AG002KLK

210169-54-3 | Phosphine, 1,1'-[(4S)-[4,4'-bi-1,3-benzodioxole]-5,5'-diyl]bis[1,1-diphenyl-

AG002KLK

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CAS Number	210169-54-3
Catalog Number	AG002KLK(AGN-PC-0QX3NL)
Chemical Name	Phosphine, 1,1'-[(4S)-[4,4'-bi-1,3-benzodioxole]-5,5'-diyl]bis[1,1-diphenyl-
IUPAC Name	[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane
InChI	InChI=1S/C38H28O4P2/c1-5-13-27(14-6-1)43(28-15-7-2-8-16-28)33-23-21-31-37(41-25-39-31)35(33)36-34(24-22-32-38(36)42-26-40-32)44(29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-24H,25-26H2
InChI Key	RZZDRSHFIVOQAF-UHFFFAOYSA-N
MDL Number	MFCD09753005
Molecular Formula	C38H28O4P2
Molecular Weight	610.5740
SMILES	P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=C(C4=C(C=CC5=C4OCO5)P(C6=CC=CC=C6)C7=CC=CC=C7)C8=C(OCO8)C=C3
Synonyms	244261-66-3, 210169-54-3, (S)-SEGPHOS, (S)-(-)-SEGPHOS, (R)-SEGPHOS, (R)-5,5'-Bis(diphenylphosphino)-4,4'-bibenzo[d][1,3]dioxole, SEGPHOS, (S)-(-)-5,5'-BIS(DIPHENYLPHOSPHINO)-4,4'-BI-1,3-BENZODIOXOLE, (R)-(+)-SEGPHOS, (R)-(+)-5,5'-BIS(DIPHENYLPHOSPHINO)-4,4'-BI-1,3-BENZODIOXOLE, (S)-5,5'-Bis(diphenylphosphino)-4,4'-bi-1,3-benzodioxole, 5,5'-Bis(diphenylphosphanyl)-4,4'-bibenzo[d][1,3]dioxole, MFCD09753005, (S)-(-)-4,4'-Bis(diphenylphosphino)-3,3'-bi(1,2-methylenedioxybenzene), [4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane, PubChem21117, (R)-SEGPHOS®, (S)-SEGPHOS®, (R)-SEGPHOS(R), (S)-SEGPHOS(R), SCHEMBL27899, (S)-DM-SEGPHOS(R), (R)-(+)-SEGPHOS®, 5,5'-Bis(diphenylphosphino)-4,4'-bi-1,3-benzodioxole, (R)-(+)-SEGPHOS(regR), (S)-(-)-SEGPHOS(regR), (R)-(+)-SEGPHOS(R), (S)-(-)-SEGPHOS(R), RZZDRSHFIVOQAF-UHFFFAOYSA-N, KS-000017TB, ZINC88367125, AKOS025213718, (R)-SEGPHOS(R), >=94%, (S)-SEGPHOS(R), >=94%, CS-W020802, SC11508, 244261-75-4, AK307031, AK312355, S0929, S0930, J-015520, 5,5'-Bis(diphenylphosphino)-4,4'-bibenzo[d][1,3]dioxole, (aS)-5,5'-Bis(diphenylphosphino)-4,4'-bi[1,3-benzodioxole], (-)-5,5'-bis(diphenylphosphanyl)-4,4'-bi[benzo-1,3-dioxolyl], (R)-5,5'-Bis(diphenylphosphanyl)-4,4'-bibenzo[d][1,3]dioxole, (R)-(+)-4,4'-Bis(diphenylphosphino)-3,3'-bi(1,2-methylenedioxybenzene), (S)-(-)-5,5'-Bis(diphenylphosphino)-4,4'-bi-1,3-benzodioxole,min.98%(S)-SEGPHOS, [4(R)-(4,4'-BI-1,3-BENZODIOXOLE)-5,5'-DIYL]BIS[DIPHENYLPHOSPHINE], (R)-(+)-5,5 inverted exclamation marka-Bis(diphenylphosphino)-4,4 inverted exclamation marka-bi-1,3-benzodioxole, (R)-(+)-5,5?-Bis(diphenylphosphino)-4,4?-bi-1,3-benzodioxole, [4(R)-(4,4?-bi-1,3-benzodioxole)-5,5?-diyl]bis[diphenylphosphine], [4(R)-(4,4 inverted exclamation marka-bi-1,3-benzodioxole)-5,5 inverted exclamation marka-diyl]bis[diphenylphosphine], CID11017510, [4-(5-diphenylphosphanylbenzo[1,3]dioxol-4-yl)benzo[1,3]dioxol-5-yl]-diphenyl-phosphane, (S)-(-)-5,5 inverted exclamation marka-Bis(diphenylphosphino)-4,4 inverted exclamation marka-bi-1,3-benzodioxole,

Complexity	787
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	610.146g/mol
Formal Charge	0
Heavy Atom Count	44
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	610.586g/mol
Monoisotopic Mass	610.146g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	36.9A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	8.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
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