Benzyl (triphenylphosphoranylidene)acetate
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Benzyl (triphenylphosphoranylidene)acetate
structure -
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CAS No:
15097-38-8
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Formula:
C27H23O2P
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Chemical Name:
Benzyl (triphenylphosphoranylidene)acetate
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Synonyms:
BENZYL (TRIPHENYLPHOSPHORANYLIDENE)ACETATE;LABOTEST-BB LT00452383;Benzyl (triphenylphosphoranylidene)acetate, 97 %;Benzyl 2-(triphenylphosphoranylidene)acetate;(BenzyloxycarbonylMethylene)triphenylphosphorane;Benzyl(triphenylphosphoranylidene)acetate 97%;Acetic acid,2-(triphenylphosphoranylidene)-, phenylMethyl ester;2-(Triphenylphosphoranylidene)acetic acid phenylmethyl ester
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CAS No:
Benzyl (triphenylphosphoranylidene)acetate Basic Attributes
410.44
410.143555
DTXSID40397527
29319019
Characteristics
26.3
5.5
White to off-white Powder
1.19±0.1 g/cm3(Predicted)
120-122 °C(lit.)
571.1±43.0 °C(Predicted)
312.0±48.5 °C
1.636
Refrigerator (+4°C)
Safety Information
NONH for all modes of transport
3
36/37/38-20/21/22
36/37/39-26-22-24/25
Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Benzyl (triphenylphosphoranylidene)acetate Use and Manufacturing
Used for Wittig reaction of tributylphosphine-mediated intercalene; for synthesis of 1,2-dioxane for trypanosomiasis activity; for organic-catalyzed Michael-type reaction of phosphorus ylide and unsaturated ketone / Wittig reaction ; Used in the reaction of stereoselective phosphine catalyzed cyclization addition to form spirocyclopentene indole; used in the enantioselective synthesis of pantothenic acid; used in the preparation of phosphorus ylides from orthophosphorus and acetic anhydride
Computed Properties
Molecular Weight:410.4
XLogP3:5.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:410.14356697
Monoisotopic Mass:410.14356697
Topological Polar Surface Area:26.3
Heavy Atom Count:30
Complexity:521
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzyl (triphenylphosphoranylidene)acetate
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