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Home > Products > Pharmaceuticals & Life Science > Pharmaceutical Intermediates > ((4S,5S)-(+)-O-[1-BENZYL-1-(5-METHYL-2-PHENYL-4,5-DIHYDRO-OXAZOL-4-YL)-2-PHENYLETHYL]-DIPHENYL-PHOSPHINITE)(1,5-COD)IRIDIUM (I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYLBORATE
((4S,5S)-(+)-O-[1-BENZYL-1-(5-METHYL-2-PHENYL-4,5-DIHYDRO-OXAZOL-4-YL)-2-PHENYLETHYL]-DIPHENYL-PHOSPHINITE)(1,5-COD)IRIDIUM (I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYLBORATE structure, CAS 405235-55-4

((4S,5S)-(+)-O-[1-BENZYL-1-(5-METHYL-2-PHENYL-4,5-DIHYDRO-OXAZOL-4-YL)-2-PHENYLETHYL]-DIPHENYL-PHOSPHINITE)(1,5-COD)IRIDIUM (I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYLBORATE

CAS Number405235-55-4

SynonymsExact Mass 1719.35000; PSA 44.41000; LogP 20.53680; InChIKey OYQSQQMXRUOJGB-UHFFFAOYSA-N

Molecular FormulaC77H58BF24IrNO2P

Molecular Weight1719.25000

Purity96%%

Density

Boiling Point

Melting Point112-113ºC

Flash Point

Appearance

EINECS

MSDSChineseEnglish

Symboltransportation

Signal WordWarning

Cat. No.: 2A-9093396 Purity: 96%%
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Quality Control of [ 405235-55-4 ] Purity: 96%% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number405235-55-4
Catalog No.2A-9093396
Chinese Name2-苯基-4-[(二苯基)(二苯基磷)甲基]-4,5-二氢-5-甲基氧唑铱
SynonymsExact Mass 1719.35000; PSA 44.41000; LogP 20.53680; InChIKey OYQSQQMXRUOJGB-UHFFFAOYSA-N
Molecular FormulaC77H58BF24IrNO2P
Molecular Weight1719.25000
Purity96%
Melting Point112-113ºC
Storage ConditionSealed in a cool, dry environment
HTC28439000
PubChem ID171061596
SMILESC1=CCCC=CCC1.CC1OC(c2ccccc2)=NC1C(Cc1ccccc1)(Cc1ccccc1)OP(c1ccccc1)c1ccccc1.FC(F)(F)c1cc([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.[Ir]
InChIInChI=1S/C37H34NO2P.C32H12BF24.C8H12.Ir/c1-29-35(38-36(39-29)32-21-11-4-12-22-32)37(27-30-17-7-2-8-18-30,28-31-19-9-3-10-20-31)40-41(33-23-13-5-14-24-33)34-25-15-6-16-26-34;34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-2-4-6-8-7-5-3-1;/h2-26,29,35H,27-28H2,1H3;1-12H;1-2,7-8H,3-6H2;/q;-1;;/t29-,35-;;;/m0.../s1
InChI KeyOYQSQQMXRUOJGB-UHFFFAOYSA-N
Hazard Symbolstransportation
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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