Phytin
Key facts
What buyers check first
- Formula
- C6H6Ca6Mg6O24P6
- Molar mass
- 1,034.23 g/mol
- EC number
- 222-798-1
- HS code
- 291990
- Category
- Sulfur and phosphorus compounds
What is Phytin?
Plain description, key identifiers and synonyms
Phytin is a chemical substance with the molecular formula C6H6Ca6Mg6O24P6 and a molar mass of 1,034.23 g/mol.
Identifiers
Registry numbers, names and line notations, tap to copy
- EC number
- 222-798-1
- Molecular formula
- C6H6Ca6Mg6O24P6
- InChIKey
- BBOWXOXQJMNGHR-UHFFFAOYSA-B
- InChI
- InChI=1S/C6H18O24P6.6Ca.6Mg/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;;;;;;;;;;;;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;;;;;;;/q;;;;;;;6*+2/p-12
- SMILES (canonical and isomeric)
- C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ca].[Ca].[Ca].[Ca].[Ca].[Ca]
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 1,034.23 g/molcalc.Computed value |
|---|---|
| Exact mass | 1,031.4533 Dacalc.Computed value |
| LogP (octanol/water) | -15.29calc.Computed value |
| Topological polar surface area | 434.5 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 24calc.Computed value |
| Rotatable bonds | 12calc.Computed value |
| Heavy atoms | 48calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 1calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Components | 13calc.Computed value |
| Lipinski rule of five | Fails (2 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H319Causes serious eye irritation.
Precautionary statements (4)
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P337 + P317If eye irritation persists: Get medical help.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidPhytin suppliers
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Phytin price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Phytin is traded under.
Phosphoric, and their salts, including lactophosphates, their halogenated, sulphonated, nitrated…
- United States15.8%
- South Korea10.1%
- Germany6.4%
The HS code shown for Phytin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Phytin, based on the data on this page
What is Phytin?
What is the molecular formula and weight of Phytin?
Is Phytin hazardous?
What is the HS code of Phytin?
Where can I buy Phytin?
What is the price of Phytin?
Guides for buyers
Practical guides that help when you source, ship or handle Phytin
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
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