Organic phosphonic acids and derivatives

Organic compounds that consist of phosphonic acid with organic functional group substitutions; includes compounds that are derived from organic phosphonic acids.

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181 – 195 of 456 results

181

Trimethyl Phosphonoacetate 96.0+%, TCI America™

CAS: 5927-18-4 Molecular Formula: C5H11O5P Molecular Weight (g/mol): 182.112 MDL Number: MFCD00008452 InChI Key: SIGOIUCRXKUEIG-UHFFFAOYSA-N Synonym: trimethyl phosphonoacetate,methyl 2-dimethoxyphosphoryl acetate,trimethyl phosphonacetate,trimethylacetyl phosphate,acetic acid, dimethoxyphosphinyl-, methyl ester,methyl-dimethoxyphosphoryl acetat,trimethyl phosphoroacetate,phosphonoacetic acid trimethyl ester,methyl dimethylphosphonoacetate,methyl dimethoxyphosphoryl acetate PubChem CID: 80029 IUPAC Name: methyl 2-dimethoxyphosphorylacetate SMILES: COC(=O)CP(=O)(OC)OC

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PubChem CID	80029
CAS	5927-18-4
Molecular Weight (g/mol)	182.112
MDL Number	MFCD00008452
SMILES	COC(=O)CP(=O)(OC)OC
Synonym	trimethyl phosphonoacetate,methyl 2-dimethoxyphosphoryl acetate,trimethyl phosphonacetate,trimethylacetyl phosphate,acetic acid, dimethoxyphosphinyl-, methyl ester,methyl-dimethoxyphosphoryl acetat,trimethyl phosphoroacetate,phosphonoacetic acid trimethyl ester,methyl dimethylphosphonoacetate,methyl dimethoxyphosphoryl acetate
IUPAC Name	methyl 2-dimethoxyphosphorylacetate
InChI Key	SIGOIUCRXKUEIG-UHFFFAOYSA-N
Molecular Formula	C5H11O5P

182

Diethyl (Methylthiomethyl)phosphonate 97.0+%, TCI America™

CAS: 28460-01-7 Molecular Formula: C6H15O3PS Molecular Weight (g/mol): 198.217 MDL Number: MFCD00015131 InChI Key: RAABCCZMKIIGJW-UHFFFAOYSA-N Synonym: diethyl methylthiomethylphosphonate,diethyl methylthiomethyl phosphonate,diethyl methylthio methyl phosphonate,diethyl methylsulfanyl methylphosphonate,methylthiomethyl phosphonic acid diethyl ester,1-ethoxy methylsulfanylmethyl phosphoryl oxyethane,phosphonic acid, methylthio methyl-, diethyl ester,diethoxy methylthiomethyl phosphino-1-one,pubchem12686 PubChem CID: 520377 IUPAC Name: 1-[ethoxy(methylsulfanylmethyl)phosphoryl]oxyethane SMILES: CCOP(=O)(CSC)OCC

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PubChem CID	520377
CAS	28460-01-7
Molecular Weight (g/mol)	198.217
MDL Number	MFCD00015131
SMILES	CCOP(=O)(CSC)OCC
Synonym	diethyl methylthiomethylphosphonate,diethyl methylthiomethyl phosphonate,diethyl methylthio methyl phosphonate,diethyl methylsulfanyl methylphosphonate,methylthiomethyl phosphonic acid diethyl ester,1-ethoxy methylsulfanylmethyl phosphoryl oxyethane,phosphonic acid, methylthio methyl-, diethyl ester,diethoxy methylthiomethyl phosphino-1-one,pubchem12686
IUPAC Name	1-[ethoxy(methylsulfanylmethyl)phosphoryl]oxyethane
InChI Key	RAABCCZMKIIGJW-UHFFFAOYSA-N
Molecular Formula	C6H15O3PS

183

Diethyl Allylphosphonate 95.0+%, TCI America™

CAS: 1067-87-4 Molecular Formula: C7H15O3P Molecular Weight (g/mol): 178.17 MDL Number: MFCD00015134 InChI Key: YPJHXRAHMUKXAE-UHFFFAOYSA-N Synonym: diethyl allylphosphonate,diethyl prop-2-en-1-ylphosphonate,diethyl-allylphosphonate,acmc-1bprn,phosphonic acid, 2-propenyl-, diethyl ester,allylphosphonic acid diethyl,3-diethoxyphosphoryl-prop-1-ene,allylphosphonic acid diethyl ester,allyl phosphonic acid diethyl ester PubChem CID: 573014 IUPAC Name: diethyl (prop-2-en-1-yl)phosphonate SMILES: CCOP(=O)(CC=C)OCC

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PubChem CID	573014
CAS	1067-87-4
Molecular Weight (g/mol)	178.17
MDL Number	MFCD00015134
SMILES	CCOP(=O)(CC=C)OCC
Synonym	diethyl allylphosphonate,diethyl prop-2-en-1-ylphosphonate,diethyl-allylphosphonate,acmc-1bprn,phosphonic acid, 2-propenyl-, diethyl ester,allylphosphonic acid diethyl,3-diethoxyphosphoryl-prop-1-ene,allylphosphonic acid diethyl ester,allyl phosphonic acid diethyl ester
IUPAC Name	diethyl (prop-2-en-1-yl)phosphonate
InChI Key	YPJHXRAHMUKXAE-UHFFFAOYSA-N
Molecular Formula	C7H15O3P

184

Sodium Ibandronate 90.0+%, TCI America™

CAS: 138844-81-2 Molecular Formula: C9H22NNaO7P2 Molecular Weight (g/mol): 341.21 MDL Number: MFCD07197214 InChI Key: LXLBEOAZMZAZND-UHFFFAOYNA-M Synonym: ibandronate sodium,bondronat,boniva,ibandronate sodium salt,sodium ibandronate,1-hydroxy-3-methylpentylamino propylidene bisphosphonic acid sodium,phosphonic acid, 1-hydroxy-3-methylpentylamino propylidene bis-, monosodium salt,sodiumibandronate,ibandronic acid sodium salt PubChem CID: 23670359 IUPAC Name: sodium hydrogen {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonate SMILES: [Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O

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Specifications

PubChem CID	23670359
CAS	138844-81-2
Molecular Weight (g/mol)	341.21
MDL Number	MFCD07197214
SMILES	[Na+].CCCCCN(C)CCC(O)(P(O)(O)=O)P(O)([O-])=O
Synonym	ibandronate sodium,bondronat,boniva,ibandronate sodium salt,sodium ibandronate,1-hydroxy-3-methylpentylamino propylidene bisphosphonic acid sodium,phosphonic acid, 1-hydroxy-3-methylpentylamino propylidene bis-, monosodium salt,sodiumibandronate,ibandronic acid sodium salt
IUPAC Name	sodium hydrogen {1-hydroxy-3-[methyl(pentyl)amino]-1-phosphonopropyl}phosphonate
InChI Key	LXLBEOAZMZAZND-UHFFFAOYNA-M
Molecular Formula	C9H22NNaO7P2

185

m-Xylylenediphosphonic Acid 97.0+%, TCI America™

CAS: 144052-40-4 Molecular Formula: C8H12O6P2 Molecular Weight (g/mol): 266.126 MDL Number: MFCD22200402 InChI Key: PYWZCUXISXXGMI-UHFFFAOYSA-N PubChem CID: 19352865 IUPAC Name: [3-(phosphonomethyl)phenyl]methylphosphonic acid SMILES: C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O

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Specifications

PubChem CID	19352865
CAS	144052-40-4
Molecular Weight (g/mol)	266.126
MDL Number	MFCD22200402
SMILES	C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O
IUPAC Name	[3-(phosphonomethyl)phenyl]methylphosphonic acid
InChI Key	PYWZCUXISXXGMI-UHFFFAOYSA-N
Molecular Formula	C8H12O6P2

186

4,4'-Bis(diethylphosphonomethyl)biphenyl 98.0+%, TCI America™

CAS: 17919-34-5 Molecular Formula: C22H32O6P2 Molecular Weight (g/mol): 454.44 MDL Number: MFCD01321144 InChI Key: DRCOGQJUVZRNSQ-UHFFFAOYSA-N PubChem CID: 635132 IUPAC Name: 1-(diethoxyphosphorylmethyl)-4-[4-(diethoxyphosphorylmethyl)phenyl]benzene SMILES: CCOP(=O)(CC1=CC=C(C=C1)C2=CC=C(C=C2)CP(=O)(OCC)OCC)OCC

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Specifications

PubChem CID	635132
CAS	17919-34-5
Molecular Weight (g/mol)	454.44
MDL Number	MFCD01321144
SMILES	CCOP(=O)(CC1=CC=C(C=C1)C2=CC=C(C=C2)CP(=O)(OCC)OCC)OCC
IUPAC Name	1-(diethoxyphosphorylmethyl)-4-[4-(diethoxyphosphorylmethyl)phenyl]benzene
InChI Key	DRCOGQJUVZRNSQ-UHFFFAOYSA-N
Molecular Formula	C22H32O6P2

187

Phenylphosphonic Acid 98.0+%, TCI America™

CAS: 1571-33-1 Molecular Formula: C6H7O3P Molecular Weight (g/mol): 158.09 MDL Number: MFCD00002136 InChI Key: QLZHNIAADXEJJP-UHFFFAOYSA-N Synonym: benzenephosphonic acid,phosphonic acid, phenyl,phenyl-phosphonic acid,phosphonic acid, p-phenyl,phenyl phosphonic acid,unii-byd76t2868,sv7,pubchem21303,phosphonic acid,phenyl,wln: qpqo&r PubChem CID: 15295 IUPAC Name: phenylphosphonic acid SMILES: OP(O)(=O)C1=CC=CC=C1

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Specifications

PubChem CID	15295
CAS	1571-33-1
Molecular Weight (g/mol)	158.09
MDL Number	MFCD00002136
SMILES	OP(O)(=O)C1=CC=CC=C1
Synonym	benzenephosphonic acid,phosphonic acid, phenyl,phenyl-phosphonic acid,phosphonic acid, p-phenyl,phenyl phosphonic acid,unii-byd76t2868,sv7,pubchem21303,phosphonic acid,phenyl,wln: qpqo&r
IUPAC Name	phenylphosphonic acid
InChI Key	QLZHNIAADXEJJP-UHFFFAOYSA-N
Molecular Formula	C6H7O3P

188

1,5-Pentylenediphosphonic Acid 98.0+%, TCI America™

CAS: 4672-25-7 Molecular Formula: C5H14O6P2 Molecular Weight (g/mol): 232.11 MDL Number: MFCD00800268 InChI Key: QRKINCQKOGXVEO-UHFFFAOYSA-N Synonym: 1,5-Pentanediphosphonic Acid PubChem CID: 2773804 IUPAC Name: (5-phosphonopentyl)phosphonic acid SMILES: OP(O)(=O)CCCCCP(O)(O)=O

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Specifications

PubChem CID	2773804
CAS	4672-25-7
Molecular Weight (g/mol)	232.11
MDL Number	MFCD00800268
SMILES	OP(O)(=O)CCCCCP(O)(O)=O
Synonym	1,5-Pentanediphosphonic Acid
IUPAC Name	(5-phosphonopentyl)phosphonic acid
InChI Key	QRKINCQKOGXVEO-UHFFFAOYSA-N
Molecular Formula	C5H14O6P2

189

Diethyl (Trichloromethyl)phosphonate 96.0+%, TCI America™

CAS: 866-23-9 Molecular Formula: C5H10Cl3O3P Molecular Weight (g/mol): 255.46 MDL Number: MFCD00013666 InChI Key: RVAQSYWDOSHWGP-UHFFFAOYSA-N Synonym: diethyl trichloromethylphosphonate,diethyl trichloromethyl phosphonate,phosphonic acid, trichloromethyl-, diethyl ester,methanephosphonic acid, trichloro-, diethyl ester,diethyltrichloromethylphosphonate,wln: gxggpo&o2&o2,4-03-00-00262 beilstein handbook reference,trichloromethylphosphonic acid diethyl,diethoxyphosphino trichloromethyl-1-one PubChem CID: 70085 IUPAC Name: diethyl (trichloromethyl)phosphonate SMILES: CCOP(=O)(OCC)C(Cl)(Cl)Cl

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Specifications

PubChem CID	70085
CAS	866-23-9
Molecular Weight (g/mol)	255.46
MDL Number	MFCD00013666
SMILES	CCOP(=O)(OCC)C(Cl)(Cl)Cl
Synonym	diethyl trichloromethylphosphonate,diethyl trichloromethyl phosphonate,phosphonic acid, trichloromethyl-, diethyl ester,methanephosphonic acid, trichloro-, diethyl ester,diethyltrichloromethylphosphonate,wln: gxggpo&o2&o2,4-03-00-00262 beilstein handbook reference,trichloromethylphosphonic acid diethyl,diethoxyphosphino trichloromethyl-1-one
IUPAC Name	diethyl (trichloromethyl)phosphonate
InChI Key	RVAQSYWDOSHWGP-UHFFFAOYSA-N
Molecular Formula	C5H10Cl3O3P

190

Disodium Etidronate Hydrate 98.0+%, TCI America™

CAS: 7414-83-7 Molecular Formula: C2H6Na2O7P2 Molecular Weight (g/mol): 249.99 MDL Number: MFCD00152567 InChI Key: GWBBVOVXJZATQQ-UHFFFAOYSA-L Synonym: etidronate disodium,disodium etidronate,didronel,sodium etidronate,sodium ethidronate,sodium ethydronate,disodium ethydronate,didronel r,disodium ethanol-1,1-diphosphonate,etidronsaeure dinatriumsalz PubChem CID: 23894 ChEBI: CHEBI:4906 IUPAC Name: disodium hydrogen (1-hydrogen phosphonato-1-hydroxyethyl)phosphonate SMILES: [Na+].[Na+].CC(O)(P(O)([O-])=O)P(O)([O-])=O

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Specifications

PubChem CID	23894
CAS	7414-83-7
Molecular Weight (g/mol)	249.99
ChEBI	CHEBI:4906
MDL Number	MFCD00152567
SMILES	[Na+].[Na+].CC(O)(P(O)([O-])=O)P(O)([O-])=O
Synonym	etidronate disodium,disodium etidronate,didronel,sodium etidronate,sodium ethidronate,sodium ethydronate,disodium ethydronate,didronel r,disodium ethanol-1,1-diphosphonate,etidronsaeure dinatriumsalz
IUPAC Name	disodium hydrogen (1-hydrogen phosphonato-1-hydroxyethyl)phosphonate
InChI Key	GWBBVOVXJZATQQ-UHFFFAOYSA-L
Molecular Formula	C2H6Na2O7P2

191

Zoledronic Acid Monohydrate 98.0+%, TCI America™

CAS: 165800-06-6 Molecular Formula: C5H12N2O8P2 Molecular Weight (g/mol): 290.105 MDL Number: MFCD00867791 InChI Key: FUXFIVRTGHOMSO-UHFFFAOYSA-N Synonym: 1-Hydroxy-2-(1-imidazolyl)ethane-1,1-diphosphonic Acid PubChem CID: 121586 IUPAC Name: (1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid;hydrate SMILES: C1=CN(C=N1)CC(O)(P(=O)(O)O)P(=O)(O)O.O

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Specifications

PubChem CID	121586
CAS	165800-06-6
Molecular Weight (g/mol)	290.105
MDL Number	MFCD00867791
SMILES	C1=CN(C=N1)CC(O)(P(=O)(O)O)P(=O)(O)O.O
Synonym	1-Hydroxy-2-(1-imidazolyl)ethane-1,1-diphosphonic Acid
IUPAC Name	(1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid;hydrate
InChI Key	FUXFIVRTGHOMSO-UHFFFAOYSA-N
Molecular Formula	C5H12N2O8P2

192

Monosodium Risedronate Hemipentahydrate 98.0+%, TCI America™

CAS: 329003-65-8 Molecular Formula: C14H30N2Na2O19P4 Molecular Weight (g/mol): 700.264 MDL Number: MFCD01706268 InChI Key: HYFDYHPNTXOPPO-UHFFFAOYSA-L Synonym: Monosodium 1-Hydroxy-2-(3-pyridyl)ethylidene-1,1-diphosphonate, Risedronic Acid Monosodium Salt PubChem CID: 11954322 IUPAC Name: disodium;hydroxy-(1-hydroxy-1-phosphono-2-pyridin-3-ylethyl)phosphinate;pentahydrate SMILES: C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].O.O.O.O.O.[Na+].[Na+]

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Specifications

PubChem CID	11954322
CAS	329003-65-8
Molecular Weight (g/mol)	700.264
MDL Number	MFCD01706268
SMILES	C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)[O-].O.O.O.O.O.[Na+].[Na+]
Synonym	Monosodium 1-Hydroxy-2-(3-pyridyl)ethylidene-1,1-diphosphonate, Risedronic Acid Monosodium Salt
IUPAC Name	disodium;hydroxy-(1-hydroxy-1-phosphono-2-pyridin-3-ylethyl)phosphinate;pentahydrate
InChI Key	HYFDYHPNTXOPPO-UHFFFAOYSA-L
Molecular Formula	C14H30N2Na2O19P4

193

Tetraisopropyl Methylenediphosphonate 97.0+%, TCI America™

CAS: 1660-95-3 Molecular Formula: C13H30O6P2 Molecular Weight (g/mol): 344.325 MDL Number: MFCD00015021 InChI Key: ODTQUKVFOLFLIQ-UHFFFAOYSA-N Synonym: tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847 PubChem CID: 74266 IUPAC Name: 2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane SMILES: CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C

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Specifications

PubChem CID	74266
CAS	1660-95-3
Molecular Weight (g/mol)	344.325
MDL Number	MFCD00015021
SMILES	CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C
Synonym	tetraisopropyl methylenediphosphonate,phosphonic acid, methylenebis-, tetrakis 1-methylethyl ester,tetraisopropyl methylenebisphosphonate,unii-k46y5v9u61,tetraisopropyl methylenebis phosphonate,methylenediphosphonic acid tetraisopropyl ester,tetra-i-propylmethylenediphosphonate,2-di propan-2-yloxy phosphorylmethyl-propan-2-yloxyphosphoryl oxypropane,phosphonic acid, p,p'-methylenebis-, p,p,p',p'-tetrakis 1-methylethyl ester,dsstox_cid_24847
IUPAC Name	2-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]oxypropane
InChI Key	ODTQUKVFOLFLIQ-UHFFFAOYSA-N
Molecular Formula	C13H30O6P2

194

Diethyl 4-Methoxyphenylphosphonate 97.0+%, TCI America™

CAS: 3762-33-2 Molecular Formula: C11H17O4P Molecular Weight (g/mol): 244.227 MDL Number: MFCD00015670 InChI Key: OTUVLLBGFFIEJO-UHFFFAOYSA-N Synonym: 4-Methoxyphenylphosphonic Acid Diethyl Ester PubChem CID: 604767 IUPAC Name: 1-diethoxyphosphoryl-4-methoxybenzene SMILES: CCOP(=O)(C1=CC=C(C=C1)OC)OCC

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Specifications

PubChem CID	604767
CAS	3762-33-2
Molecular Weight (g/mol)	244.227
MDL Number	MFCD00015670
SMILES	CCOP(=O)(C1=CC=C(C=C1)OC)OCC
Synonym	4-Methoxyphenylphosphonic Acid Diethyl Ester
IUPAC Name	1-diethoxyphosphoryl-4-methoxybenzene
InChI Key	OTUVLLBGFFIEJO-UHFFFAOYSA-N
Molecular Formula	C11H17O4P

195

Diethyl 1-Pyrrolidinemethylphosphonate 95.0+%, TCI America™

CAS: 51868-96-3 Molecular Formula: C9H21NO3P Molecular Weight (g/mol): 222.24 MDL Number: MFCD00040516 InChI Key: DOMZGECNJWVKAM-UHFFFAOYSA-O Synonym: 1-Pyrrolidinemethylphosphonic Acid Diethyl Ester PubChem CID: 103998 IUPAC Name: 1-[(diethoxyphosphoryl)methyl]pyrrolidin-1-ium SMILES: CCOP(=O)(C[NH+]1CCCC1)OCC

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Specifications

PubChem CID	103998
CAS	51868-96-3
Molecular Weight (g/mol)	222.24
MDL Number	MFCD00040516
SMILES	CCOP(=O)(C[NH+]1CCCC1)OCC
Synonym	1-Pyrrolidinemethylphosphonic Acid Diethyl Ester
IUPAC Name	1-[(diethoxyphosphoryl)methyl]pyrrolidin-1-ium
InChI Key	DOMZGECNJWVKAM-UHFFFAOYSA-O
Molecular Formula	C9H21NO3P

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