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Trimethyl phosphate - analytical standard, high purity , CAS No.512-56-1

36 Citations

COA

Grade & Purity:

analytical standard

Cas Number: 512-56-1
Molecular Weight: 140.07
Beilstein Registry Number: 1071731
EC Number: 208-144-8
MDL number: MFCD00008348
PubChem CID: 10541

In stock

Item Number

T104025

Grouped product items
SKU	Size	Availability	Price
T104025-250mg	250mg	2	$101.90
T104025-500mg	500mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$179.90
T104025-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$309.90
T104025-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,202.90
T104025-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$3,434.90

Basic Description

Synonyms	NCGC00248617-01 \| P(O)(OCH3)3 \| CAS-512-56-1 \| EINECS 208-144-8 \| TRIMETHYL PHOSPHATE [HSDB] \| Trimethylfosfat [Czech] \| NCGC00248617-02 \| CCRIS 610 \| Tox21_302740 \| AI3-05905 \| NSC 58985 \| UNII-Z1E45TMW1Z \| InChI=1/C3H9O4P/c1-5-8(4,6-2)7-3/h1-3H \| NCGC00
Specifications & Purity	analytical standard
Shipped In	Normal
Grade	analytical standard

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Organic phosphoric acids and derivatives
    - Subclass Phosphate esters
      - Level5 Alkyl phosphates
        Level6 Trialkyl phosphates

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Organic phosphoric acids and derivatives
Subclass	Phosphate esters
Intermediate Tree Nodes	Alkyl phosphates
Direct Parent	Trialkyl phosphates
Alternative Parents	Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Trialkyl phosphate - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as trialkyl phosphates. These are organic compounds containing a phosphate group that is linked to exactly three alkyl chains.
External Descriptors	trialkyl phosphate
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	trimethyl phosphate
INCHI	InChI=1S/C3H9O4P/c1-5-8(4,6-2)7-3/h1-3H3
InChIKey	WVLBCYQITXONBZ-UHFFFAOYSA-N
Smiles	COP(=O)(OC)OC
Isomeric SMILES	COP(=O)(OC)OC
WGK Germany	1
RTECS	TC8225000
PubChem CID	10541
Molecular Weight	140.07
Beilstein	1071731
Reaxy-Rn	1071731

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
C2223694	Certificate of Analysis	Dec 21, 2023	T104025
C2223696	Certificate of Analysis	Dec 21, 2023	T104025
C2223534	Certificate of Analysis	Dec 21, 2023	T104025
C2223693	Certificate of Analysis	Dec 21, 2023	T104025
C2223697	Certificate of Analysis	Dec 21, 2023	T104025
K1915060	Certificate of Analysis	Aug 14, 2023	T104025
B2306898	Certificate of Analysis	Feb 17, 2023	T104025

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Refractive Index	1.3967
Flash Point(°F)	302 °F
Flash Point(°C)	107℃
Boil Point(°C)	197.2°C
Melt Point(°C)	-46°C
Molecular Weight	140.070 g/mol
XLogP3	-0.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	140.024 Da
Monoisotopic Mass	140.024 Da
Topological Polar Surface Area	44.800 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	82.400
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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