Phosphoric Acid - 75% (v/v) , CAS No.7664-38-2

CAS: 7664-38-2 Cat. No.: P291651 Formula: H₃PO₄ Molecular Weight: 98.00 Beilstein Registry Number: 1921286 EC Number: 231-633-2

GRADE & PURITY 75% (v/v)

Synonyms

Phosphoric acid|7664-38-2|ORTHOPHOSPHORIC ACID|o-Phosphoric acid|Wc-reiniger|Acidum phosphoricum|Sonac|Phosphorsaeure|Evits|Acide phosphorique|Phosphoricum acidum|Acido fosforico|Phosphorsaeureloesungen|Fosforzuuroplossingen|Vococid|White phosphoric acid|

Storage

Room temperature

Shipped In

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Specifications

Synonyms

Phosphoric acid | 7664-38-2 | ORTHOPHOSPHORIC ACID | o-Phosphoric acid | Wc-reiniger | Acidum phosphoricum | Sonac | Phosphorsaeure | Evits | Acide phosphorique | Phosphoricum acidum | Acido fosforico | Phosphorsaeureloesungen | Fosforzuuroplossingen | Vococid | White phosphoric acid |

Specifications & Purity

75% (v/v)

Storage

Room temperature

Shipped In

FedEx DG Service

Names and Identifiers

• Pubchem Sid: 528774355
• Canonical Smiles: OP(=O)(O)O
• IUPAC Name: phosphoric acid
• InChIKey: NBIIXXVUZAFLBC-UHFFFAOYSA-N
• INCHI: 1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)
• Isomeric SMILES: OP(=O)(O)O
• WGK Germany: 1
• RTECS: TB6300000
• UN Number: 1805
• Packing Group: III
• Molecular Weight: 98.00
• Beilstein: 1921286
• Reaxy-Rn: 1921286
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1921286&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Inorganic compounds
  • Superclass Homogeneous non-metal compounds
    • Class Non-metal oxoanionic compounds
      • Subclass Non-metal phosphates

• Kingdom: Inorganic compounds
• Superclass: Homogeneous non-metal compounds
• Class: Non-metal oxoanionic compounds
• Subclass: Non-metal phosphates
• Intermediate Tree Nodes: Not available
• Direct Parent: Non-metal phosphates
• Alternative Parents: Inorganic oxides
• Molecular Framework: Not available
• Substituents: Non-metal phosphate - Inorganic oxide
• Description: This compound belongs to the class of inorganic compounds known as non-metal phosphates. These are inorganic non-metallic compounds containing a phosphate as its largest oxoanion.
• External Descriptors: phosphoric acids

Data sources

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

Associated Targets(Human)

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SRC Tclin Tyrosine-protein kinase SRC (10310 Activities)

Discover Target: SRC

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

OTC Tchem Ornithine carbamoyltransferase (24 Activities)

Discover Target: OTC

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC16A1 Tchem Monocarboxylate transporter 1 (146 Activities)

Discover Target: SLC16A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

panE Ketopantoate reductase (28 Activities)

Discover Target: panE

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Fe(3+)-Zn(2+) purple acid phosphatase (65 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Boil Point(°C): 158°C
• Melt Point(°C): 42.35°C
• Molecular Weight: 97.995 g/mol
• XLogP3: -2.100
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 97.9769 Da
• Monoisotopic Mass: 97.9769 Da
• Topological Polar Surface Area: 77.800 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 49.800
• 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