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849925-24-2 | (S)-1-{(SP)-2-[2-[Di(3,5-xylyl)phosphino]phenyl]ferrocenyl}ethyldi(3,5-xylyl)phosphine
CAS No: 849925-24-2 Catalog No: AG003CJN MDL No:
Product Description
Catalog Number:
AG003CJN
Chemical Name:
(S)-1-{(SP)-2-[2-[Di(3,5-xylyl)phosphino]phenyl]ferrocenyl}ethyldi(3,5-xylyl)phosphine
CAS Number:
849925-24-2
IUPAC Name:
[(1R)-1-[(5E)-5-[6-bis(3,5-dimethylphenyl)phosphanylcyclohexa-2,4-dien-1-ylidene]cyclopenta-1,3-dien-1-yl]ethyl]-bis(3,5-dimethylphenyl)phosphane;cyclopenta-1,3-diene;iron(2+)
InChI:
InChI=1S/C45H47P2.C5H5.Fe/c1-29-17-30(2)22-38(21-29)46(39-23-31(3)18-32(4)24-39)37(9)42-14-12-15-43(42)44-13-10-11-16-45(44)47(40-25-33(5)19-34(6)26-40)41-27-35(7)20-36(8)28-41;1-2-4-5-3-1;/h10-28,37H,1-9H3;1-5H;/q2*-1;+2/b44-43+;;/t37-;;/m1../s1
InChI Key:
BOIJKQHZTBIFFX-MBJAOMMLSA-N
Properties
Complexity:
1140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
770.289g/mol
Formal Charge:
0
Heavy Atom Count:
53
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
770.759g/mol
Monoisotopic Mass:
770.289g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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