AG001MYO

15097-38-8 | Acetic acid, 2-​(triphenylphosphoran​ylidene)​-​, phenylmethyl ester

AG001MYO

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CAS Number	15097-38-8
Catalog Number	AG001MYO(AGN-PC-0BXGL3)
Chemical Name	Acetic acid, 2-​(triphenylphosphoran​ylidene)​-​, phenylmethyl ester
IUPAC Name	benzyl 2-(triphenyl-λ5-phosphanylidene)acetate
InChI	InChI=1S/C27H23O2P/c28-27(29-21-23-13-5-1-6-14-23)22-30(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2
InChI Key	INKMLGJBBDRIQR-UHFFFAOYSA-N
MDL Number	MFCD00191787
Molecular Formula	C27H23O2P
Molecular Weight	410.4441
SMILES	P(=CC(=O)OCc1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
Synonyms	15097-38-8, Benzyl 2-(triphenylphosphoranylidene)acetate, BENZYL (TRIPHENYLPHOSPHORANYLIDENE)ACETATE, Benzyl(triphenylphosphoranylidene)acetate, benzyl (triphenylphosphoranylidene)-acetate, Benzyl (triphenyl-lambda~5~-phosphanylidene)acetate, Acetic acid, (triphenylphosphoranylidene)-, phenylmethyl ester, phenylmethyl 2-(triphenylylidene)acetate, Benzyl (triphenylphosphoranylidene)acetate, 97%, MFCD00191787, benzyl 2-(triphenyl-, ACMC-20ah9g, AC1MYV4I, KSC526Q3L, SCHEMBL2389657, C27H23O2P, CTK4C6835, DTXSID40397527, INKMLGJBBDRIQR-UHFFFAOYSA-N, KS-00000FQ7, 7560AA, ANW-73298, BBL103078, GEO-02511, SBB057721, STL556888, AKOS015909319, ZINC100004393, MCULE-1282382272, NE47763, TRA0074124, benzyl triphenylphosphoranylidene-acetate, AK105127, SY045501, AB0063130, benzyloxycarbonylmethylene triphenylphosphorane, benzyloxycarbonylmethylene-triphenylphosphorane, ST24030144, ST51006896, MFCD00191787 (97%), (Benzyloxycarbonylmethylene)triphenylphosphorane, benzyl 2-(triphenyl-??-phosphanylidene)acetate, Benzyl(triphenylphosphoranylidene)acetate, 97%, benzyloxycarbonylmethylene triphenyl phosphorane, benzyl (triphenyl-lambda5-phosphanylidene)acetate, Triphenylphosphoranylideneacetic acid benzyl ester, benzyl 2-(triphenyl-lambda-phosphanylidene)acetate, W-200126, I14-33683, 2-(Triphenylphosphoranylidene)acetic acid phenylmethyl ester, Acetic acid,2-(triphenylphosphoranylidene)-, phenylmethyl ester, Acetic acid, 2-(triphenylphosphoranylidene)-, phenylmethyl ester, ACN-051517, CID3862746, Benzyl 2-triphenylphosphoranylideneacetate, Benzyl(triphenylphosphoranylidene)acetate, 97% - 25G 25g,

Complexity	521
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	410.144g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	410.453g/mol
Monoisotopic Mass	410.144g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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