AG0082XR

108957-75-1 | Phosphonic acid,P-[(3,5-dimethoxyphenyl)methyl]-, diethyl ester

AG0082XR

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CAS Number	108957-75-1
Catalog Number	AG0082XR(AGN-PC-0093OA)
Chemical Name	Phosphonic acid,P-[(3,5-dimethoxyphenyl)methyl]-, diethyl ester
IUPAC Name	1-(diethoxyphosphorylmethyl)-3,5-dimethoxybenzene
InChI	InChI=1S/C13H21O5P/c1-5-17-19(14,18-6-2)10-11-7-12(15-3)9-13(8-11)16-4/h7-9H,5-6,10H2,1-4H3
InChI Key	VYWCMXXBAOVBSJ-UHFFFAOYSA-N
MDL Number	MFCD18252337
Molecular Formula	C13H21O5P
Molecular Weight	288.2766
SMILES	COC1=CC(OC)=CC(CP(OCC)(OCC)=O)=C1
Synonyms	Diethyl 3,5-Dimethoxybenzylphosphonate, 108957-75-1, Phosphonic acid,P-[(3,5-dimethoxyphenyl)methyl]-, diethyl ester, ACMC-1BTQ1, SCHEMBL1486664, CTK4A6252, DTXSID50465908, VYWCMXXBAOVBSJ-UHFFFAOYSA-N, ZINC22057332, RL00384, diethyl-(3,5-dimethoxybenzyl)phosphonate, DA-15734, diethyl (3,5-dimethoxybenzyl)-phosphonate, RT-012330, FT-0666761, 3,5-Dimethoxybenzylphosphonic acid diethyl ester, 1-(diethoxyphosphorylmethyl)-3,5-dimethoxybenzene, J-520292, (3,5-Dimethoxy-benzyl)-phosphonic acid diethyl ester, P-[(3,5-Dimethoxyphenyl)methyl]phosphonic Acid Diethyl Ester, CID11437684, 1-(diethoxyphosphorylmethyl)-3,5-dimethoxy-benzene,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.113g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.28g/mol
Monoisotopic Mass	288.113g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	54A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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