Basic information
- Standard SMILES
COP(=O)(Cl)OC- InChIKey
NGFFLHMFSINFGB-UHFFFAOYSA-N- Molecular formula
- C2H6ClO3P
- Average molar mass
- 144.49 g/mol
- Monoisotopic mass
- 143.97430836
Names & identifiers
- Preferred name
- Phosphorochloridic acid, dimethyl ester
- IUPAC
- [chloro(methoxy)phosphoryl]oxymethane
- English name
- DIMETHYL PHOSPHOROCHLORIDATE
- Molecular formula
- C2H6ClO3P
- Molecular weight
- 144.49
Names & synonyms
813-77-4Dimethyl chlorophosphatePhosphorochloridic acid, dimethyl esterMethyl phosphorochloridateDTXSID90231043RefChem:862799DTXCID90153534629-400-9Dimethyl phosphorochloridate[chloro(methoxy)phosphoryl]oxymethaneDimethyl chlorophosphonateMFCD00117904
Show more names
Dimethyl phosphoryl chloridateDimethyl chloridophosphateDimethyl phosphochloridateDimethylphosphoryl chlorideDimethyl phosphorchloridate
Chlorodimethoxyphosphine oxidePhosphorochloridic acid dimethyl esterDimethyl Phosphorochloridate (90per cent)DimethylchlorophosphatedimethylphosphorochloridateDimethyl Phosphorochloridate (90%)ChlorodimethylphosphateDimethyl phosphorochloride
Database identifiers
- CAS
813-77-4- PubChem CID
- 101863
- DTXSID
DTXSID90231043- EC Number
- 629-400-9
- Nikkaji
- J24.093A
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 84.9
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Boiling point
- 80 °C/25 · 80 °C/25 mmHg (lit.)
- Density
- 1.34 g/mL · 1.34 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.413(lit.)
- Flash point
- 230 °F · >230 °F
- solubility
- Acetonitrile (Slightly), Chloroform (Slightly)
- form
- clear liquid
- color
- Colorless to Almost colorless
- Stability
- Hygroscopic, Moisture Sensitive
- InChI
- InChI=1S/C2H6ClO3P/c1-5-7(3,4)6-2/h1-2H3
- InChIKey
- NGFFLHMFSINFGB-UHFFFAOYSA-N
- SMILES
- P(Cl)(OC)(OC)=O
- CAS DataBase Reference
- 813 · 813-77-4
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 300 · H300+H310+H330-H314
- Precautionary statements
- 260 · P260-P270-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- T+
- Risk Statements
- 26 · 26/27/28-34
- Safety Statements
- 26 · 26-36/37/39-45-7/9
- RIDADR
- 2927 · UN 2927 6.1/PG 1
- WGK Germany
- 3 · 3
- HazardClass
- 6.1 · 6.1, 8
- HS Code
- 29199000 · 29199000
- Storage Class
- 6.1 A · 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- 2 DermalAcute · Acute Tox. 2 DermalAcute Tox. 2 InhalationAcute Tox. 2 OralEye Dam. 1Skin Corr. 1B
- Limited Quantities
- 100 ml · 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H300 (97.6%): Fatal if swallowed [Danger Acute toxicity, oral]
P260, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 2 (97.6%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 2927 6.1/PG 1
- hs_code
- 29199000
- risk_code
- 26/27/28-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- hazard_code
- T+
- safety_code
- 26-36/37/39-45-7/9
- hazard_class
- 6.1, 8
- Storage Class
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard statements
- H300+H310+H330-H314
- Limited Quantities
- 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Acute Tox. 2 DermalAcute Tox. 2 InhalationAcute Tox. 2 OralEye Dam. 1Skin Corr. 1B
- Precautionary statements
- P260-P270-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Chemistry & industry
Applications
UsesA phosphorylating agent
UsesDimethyl chlorophosphate may be used for the preparation of (E)-3-cyanophosphoenolpyruvate, by reaction with the potassium enolate of ethyl cyanopyruvate. It may be used for the synthesis of mono- and diphosphate esters of 2-arachidonyl glyceryl ether.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 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]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
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上海景颜化工科技有限公司13817811078 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
维赛诺化学技术（北京）有限公司13811761079 · [email protected]
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HONG KONG IPURE BIOLOGY CO.,LIMITED86 18062405514 18062405514 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
ZHEJIANG JIUZHOU CHEM CO., LTD+86-0576225566889 +86-13454675544 · [email protected]；[email protected]；[email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
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陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
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湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
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HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
R&D Scientific Inc.+1-2266000236 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
深圳市大物科技有限责任公司0752-5555973 13923768523 · [email protected]
湖北万业众诚化学试剂有限责任公司18671296875 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
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湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
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上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
Watson Biotechnology Co.,Ltd+86-18186686046 · [email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
Related reactions
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