Cas no 812-00-0 (Phosphoric acid,monomethyl ester)
812-00-0 structure
Product Name:Phosphoric acid,monomethyl ester
Phosphoric acid,monomethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric acid,monomethyl ester
- methyl dihydrogen phosphate
- METHYL PHOSPHATE
- Dihydrogen methyl phosphate
- methanehydroxyphosphonic acid
- methyl phosphoric acid
- monomethyl phosphate
- O-Methyl phosphate
- phosphoric acid mono ester
- B1B92FE0-7CC2-45F3-94D3-DA8B65F81BEB
- methanol-phosphate
- MFCD00015936
- 4-01-00-01258 (Beilstein Handbook Reference)
- CHEMBL344340
- Methyl phosphate ((CH3O)(HO)2PO)
- methanolphosphate
- Phosphoric acid monomethyl ester
- Monomethylphophate
- NSC41908
- CAAULPUQFIIOTL-UHFFFAOYSA-N
- FT-0695119
- Phosphoric acid, monomethyl ester
- NSC 41908
- 12789-45-6
- Methyl phosphate ((MeO)(HO)2PO)
- NSC-41908
- NS00019499
- DTXSID2025684
- SCHEMBL19942
- Monomethyl dihydrogen phosphate
- Monomethylphosphate
- Epitope ID:150903
- EINECS 212-379-1
- 7C7GH393JL
- Methyl phosphate, (MeO)(HO)2PO
- BRN 1701224
- Methylphosphate
- Q23993898
- 812-00-0
- CHEBI:340824
-
- MDL： MFCD00015936
- Inchi： 1S/CH5O4P/c1-5-6(2,3)4/h1H3,(H2,2,3,4)
- InChI Key： CAAULPUQFIIOTL-UHFFFAOYSA-N
- SMILES： P(=O)(O)(O)OC
Computed Properties
- Exact Mass: 111.99300
- Monoisotopic Mass: 111.99254563g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 6
- Rotatable Bond Count: 1
- Complexity: 71.6
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.6
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 76.57000
- LogP: -0.27450
Phosphoric acid,monomethyl ester Security Information
- Hazardous Material transportation number：UN 3265
- HazardClass：8
- PackingGroup：III
- Safety Term：8
- Packing Group：III
Phosphoric acid,monomethyl ester Related Literature
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
812-00-0 (Phosphoric acid,monomethyl ester) Related Products
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- 512-56-1(Trimethyl phosphate)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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