CAS 25383-06-6 P-(1Z)-1-Propen-1-ylphosphonic acid (HCID 6436667)

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Basic information

CAS: 25383-06-6
Standard SMILES: C/C=C\P(=O)(O)O
InChIKey: XWCIXXXLOAAWPU-IHWYPQMZSA-N
Molecular formula: C3H7O3P
Average molar mass: 122.06 g/mol
Monoisotopic mass: 122.01328108

Names & identifiers

Preferred name: P-(1Z)-1-Propen-1-ylphosphonic acid
IUPAC: [(Z)-prop-1-enyl]phosphonic acid
English name: cis-propenylphosphonic acid
Molecular formula: C3H7O3P
Molecular weight: 122.06

Names & synonyms

25383-06-6Propenylphosphonic acidP-(1Z)-1-Propen-1-ylphosphonic acidDTXSID801293064RefChem:577420DTXCID401723627PPOHcis-Propenylphosphonic acid(Z)-Prop-1-en-1-ylphosphonic acid[(Z)-prop-1-enyl]phosphonic acidMFCD22373409cis-propenyl phosphonic acid

Show more names

cis-propenyl phosphateSodium cis-apropionateCis-Propenylphosphoric acid(Z)-prop-1-enyl]phosphonicaci(Z)-1-Propenylphosphonic acid

[(Z)-Prop-1-enyl]phosphonic Acid (Technical Grade)[(Z)-1-Propenyl]phosphonic acidEINECS 246-928-1EC 246-928-1Propenylphosphonic acid, cis-SCHEMBL462085P6Z7P82J2L((Z)-Propenyl)-phosphonic acid

Database identifiers

CAS: 25383-06-6
PubChem CID: 6436667
DTXSID: DTXSID801293064
UNII: P6Z7P82J2L
EC Number: 246-928-1
Nikkaji: J21.047A

Properties

Computed structural properties

XLogP: -0.9
Topological polar surface area: 57.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 7
Formal charge: 0
Complexity: 111

Physicochemical properties

Boiling point: 274.1 · 274.1±23.0 °C(Predicted)
Density: 1.343 · 1.343±0.06 g/cm3(Predicted)
storage temp.: Hygroscopic, Refrigerator, under inert atmosphere
solubility: DMSO, Methanol (Slightly)
pka: 1.59 · 1.59±0.10(Predicted)
form: Oil
color: Pale Yellow
Stability: Hygroscopic
InChI: InChI=1S/C3H7O3P/c1-2-3-7(4,5)6/h2-3H,1H3,(H2,4,5,6)/b3-2-
InChIKey: XWCIXXXLOAAWPU-IHWYPQMZSA-N
SMILES: P(/C=C\C)(=O)(O)O
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory InformationStatus: Active Update: 19-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/6103

Hazard Classes and CategoriesSkin Corr. 1A (100%)

Regulatory information

Regulatory InformationStatus: Active Update: 19-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/6103

Safety data

Signal word: Danger
Symbol(GHS): GHS05
Hazard statements: H314
REACH Registrations: Active
Precautionary statements: P280-P305+P351+P338-P310

Chemistry & industry

Applications

Uses[(Z)-Prop-1-enyl]phosphonic Acid could be useful as a pumping agent in concrete or cement.

Suppliers70 total

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

Related reactions

1 records

New reaction record

HRID 267564As reactantuspto-grants-1976_03

Compound notes

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