AG004HH3

87460-09-1 | (2-(Benzyloxy)-2-oxoethyl)(4-phenylbutyl)phosphinic acid

AG004HH3

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CAS Number	87460-09-1
Catalog Number	AG004HH3(AGN-PC-00LCNI)
Chemical Name	(2-(Benzyloxy)-2-oxoethyl)(4-phenylbutyl)phosphinic acid
IUPAC Name	(2-oxo-2-phenylmethoxyethyl)-(4-phenylbutyl)phosphinic acid
InChI	InChI=1S/C19H23O4P/c20-19(23-15-18-12-5-2-6-13-18)16-24(21,22)14-8-7-11-17-9-3-1-4-10-17/h1-6,9-10,12-13H,7-8,11,14-16H2,(H,21,22)
InChI Key	GVDMCYBWLREELG-UHFFFAOYSA-N
MDL Number	MFCD09033183
Molecular Formula	C19H23O4P
Molecular Weight	346.3573
SMILES	OP(=O)(CCCCC1=CC=CC=C1)CC(=O)OCC1=CC=CC=C1
Synonyms	87460-09-1, Benzyl hydroxy(4-phenylbutyl)phosphinoylacetate, (2-(Benzyloxy)-2-oxoethyl)(4-phenylbutyl)phosphinic acid, hydroxyl(4-phenylbutyl)pjosphinyl]benzyl acetate, [2-(Benzyloxy)-2-oxoethyl](4-phenylbutyl)phosphinic acid, Q-100874, HYDROXYL(4-PHENYLBUTYL)PHOSPHINYL]BENZYL ACETATE, [Hydroxy(4-phenylbutyl)phosphinyl]acetic acid, phenylmethyl ester, [Hydroxy-(4-phenylbutyl)phosphinyl]acetic acid phenylmethyl ester, Acetic acid, [hydroxy(4-phenylbutyl)phosphinyl]-, phenylmethyl ester, BENZYL [HYDROXY-(4-PHENYLBUTYL)PHOSPHINYL] ACETATE, PubChem14027, fosinopril intermediate aa, [hydroxyl-(4-butylbenzene), C19H23O4P, DTXSID40525888, GVDMCYBWLREELG-UHFFFAOYSA-N, BCP13511, KS-000011HZ, CB-877, CH0026, KM2517, MFCD09033183, ZINC21300609, AKOS015888651, AC-6232, RP17674, VZ32396, AJ-78332, AJ-78333, AK110843, AN-10225, AS-15373, BC220576, P082, AX8022937, TL8005689, Benzyl Hydroxy(4-phenylbutyl)phosphinoacetate, FT-0652813, 460B091, I01-1159, [Hydroxyl-(4-butylbenzene) phosphoroso] benzyl acetate, (2-benzyloxy-2-oxo-ethyl)-(4-phenylbutyl)phosphinic acid, (2-oxo-2-phenylmethoxyethyl)-(4-phenylbutyl)phosphinic acid, [Hydroxy(4-phenylbutyl)phosphinyl]acetic acid,enylmethyl ester, 2-(BENZYLOXY)-2-OXOETHYL(4-PHENYLBUTYL)PHOSPHINIC ACID, BENZYL [HYDROXY-(4-PHENYL-BUTYL)-PHOSPHINOYL]-ACETATE, [Hydroxy-(4-phenyl-butyl)-phosphinoyl]-acetic acid benzyl ester, [Hydroxy-(4-phenylbutyl)phosphinyl]acetic acid, phenylmethyl ester, 2-(benzyloxy)-2-oxoethyl(4-phenylbutyl)phosphinicacid(fosinoprilintermediate), [Hydroxy(4-phenylbutyl)phosphinyl]acetic Acid, EC 416-050-5, benzyl (hydroxy-(4-phenylbutyl)phosphinyl) acetate, (2-(Benzyloxy)-2-oxoethyl)(4-phenylbutyl)phosphinicacid, (hydroxy-(4-phenylbutyl)phosphinyl)acetic acid phenylmethyl ester,

Complexity	412
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	346.133g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	346.363g/mol
Monoisotopic Mass	346.133g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H317-H319-H335-H360
Packing Group	Ⅲ
Precautionary statements	P201-P261-P280-P305+P351+P338-P308+P313
UN Code	UN 2811

Certificate of Analysis

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