(4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER (CAS 1552-41-6) — formula C12H16NO3P, molecular weight 253.23; category organic chemicals.
| CAS Number | 1552-41-6 |
|---|---|
| Molecular Formula | C12H16NO3P |
| Molecular Weight | 253.23 |
| LogP | 1.4 |
| Category | Organic Chemicals |
(4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER is a carbon-based organic compound with CAS registry number 1552-41-6 and molecular formula C12H16NO3P (molecular weight 253.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1552-41-6
Its molecular formula C12H16NO3P comprises 12 C, 16 H, 1 N, 3 O, 1 P atoms.
Also known as: (4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER · (4-氰基苄基)膦酸二乙酯
Category: organic chemicals
The CAS registry number of (4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER is 1552-41-6.
Molecular formula C12H16NO3P, molecular weight 253.23.
It is also registered under: (4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER, (4-氰基苄基)膦酸二乙酯.
Category: Organic Chemicals.
Independent reference data for (4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER (CAS 1552-41-6), compiled from public chemistry databases.
| CAS Registry Number | 1552-41-6 |
|---|---|
| PubChem CID | 241438 |
| Molecular formula | C12H16NO3P |
| IUPAC name | 4-(diethoxyphosphorylmethyl)benzonitrile |
| UNII (FDA) | C12H16NO3P |
| Molecular Weight | 253.23 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 253.08678037 |
| Monoisotopic Mass | 253.08678037 |
| Topological Polar Surface Area | 59.3 |
| Heavy Atom Count | 17 |
Diethyl (4-Cyanobenzyl)phosphonate; DTXSID50287061; RefChem:587020; DTXCID40238209; 605-002-0; 1552-41-6; diethyl 4-cyanobenzylphosphonate; 4-(diethoxyphosphorylmethyl)benzonitrile; (4-Cyanobenzyl)phosphonic Acid Diethyl Ester; MFCD08274488; 4-(Diethylphosphonomethyl)benzonitrile; diethyl (4-cyanophenyl)methylphosphonate; SCHEMBL578310; Phosphonic acid, P-[(4-cyanophenyl)methyl]-, diethyl ester; diethyl-p-cyanobenzyl phosphonate; BP-12171
| Reported hazard statements | H301, H311, H331 (50%), H315 (100%), H319 (100%), H335 (50%) |
|---|
H301+H311+H331 (50%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
(4-CYANOBENZYL)PHOSPHONIC ACID DIETHYL ESTER · CAS 1552-41-6 · C12H16NO3P. UNII C12H16NO3P.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (4-氰基苄基)膦酸二乙酯