Acidorange74
Key facts
What buyers check first
- Formula
- C16H11CrN5NaO8S
- Molar mass
- 508.34 g/mol
- HS code
- 293319
- Category
- Heterocyclic compounds
What is Acidorange74?
Plain description, key identifiers and synonyms
Acidorange74 is a chemical substance with the molecular formula C16H11CrN5NaO8S and a molar mass of 508.34 g/mol. The IUPAC name is sodium, chromium(3+), 3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate, hydroxide.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- sodium, chromium(3+), 3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate, hydroxide
- Molecular formula
- C16H11CrN5NaO8S
- InChIKey
- PKKMPNLKTQQJEF-UHFFFAOYSA-J
- InChI
- InChI=1S/C16H13N5O7S.Cr.Na.H2O/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(21(24)25)8-13(15(12)22)29(26,27)28;;;/h2-8H,1H3,(H3,17,18,19,22,23,26,27,28);;;1H2/q;+3;+1;/p-4
- SMILES (canonical and isomeric)
- CC1=C(C(=O)N([N-]1)C2=CC=CC=C2)N=NC3=C(C(=CC(=C3)[N+](=O)[O-])S(=O)(=O)[O-])[O-].[OH-].[Na+].[Cr+3]
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 | 508.34 g/molcalc.Computed value |
|---|---|
| Exact mass | 507.9631 Dacalc.Computed value |
| LogP (octanol/water) | -1.77calc.Computed value |
| Topological polar surface area | 214.2 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 10calc.Computed value |
| Rotatable bonds | 5calc.Computed value |
| Heavy atoms | 32calc.Computed value |
| Rings | 3calc.Computed value |
| Aromatic rings | 3calc.Computed value |
| Fraction sp3 carbons | 0.06calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Components | 4calc.Computed value |
| Lipinski rule of five | Passes (1 violation)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
![Murcko scaffold of this chemical, O=c1c(N=Nc2ccccc2)c[nH]n1-c1ccccc1](/scaffold/NRYKBUOQTITJGB-UHFFFAOYSA-N/structure.svg)
O=c1c(N=Nc2ccccc2)c[nH]n1-c1ccccc1
3 rings, 20 atoms, the 1H-Pyrazole-4,5-dione, 1-phenyl-, 4-(phenylhydrazone) ring system.
189 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Acidorange74 suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
Post one free request and suppliers who make or trade Acidorange74 can send you quotes. Your contact details stay private until you accept a quote.
Acidorange74 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 Acidorange74 is traded under.
Compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the…
- China21.6%
- Switzerland * partner reported20.5%
- Germany19.0%
* Partner reported figures, a lower bound.
The HS code shown for Acidorange74 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Related chemicals
Parent and salt forms, stereoisomers, similar structures and isomers
Parent compound
The neutral parent of this salt, hydrate or mixture
Similar structures
Nearest neighbours by Morgan fingerprint Tanimoto similarity
![Chromium, [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulfonato(3-)]- chemical structure, C16H10CrN5O7S, CAS 72845-71-7](/s/NISQHFVUFSZZGU-UHFFFAOYSA-K.svg)
![Chromium(3+), hydron, 2-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]benzoate, 3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate chemical structure, C33H24CrN9O10S, CAS 72986-94-8](/s/PKZSBQUYCMUQKQ-UHFFFAOYSA-K.svg)
![Chromium(3+), hydron, 2-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-4-nitrophenolate, 5-nitro-2-oxido-3-[(2-oxidonaphthalen-1-yl)diazenyl]benzenesulfonate chemical structure, C32H21CrN8O11S, CAS 73287-45-3](/s/ZOHNWIGPBRDNEM-UHFFFAOYSA-K.svg)
![5-Chloro-3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-2-oxidobenzenesulfonate, chromium(3+), hydron, 2-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-4-nitrophenolate chemical structure, C32H23ClCrN9O9S, CAS 72986-96-0](/s/USKVNYDPMUZMFJ-UHFFFAOYSA-K.svg)
![Trisodium bis[5-chloro-2-(hydroxy-kappaO)-3-{[3-methyl-5-(oxo-kappaO)-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl]diazenyl-kappaN1}benzenesulfonato(3-)]chromate(3-) chemical structure, C32H20Cl2CrN8Na3O10S2, CAS 73324-05-7](/s/DXPAOLYTTYYQMZ-UHFFFAOYSA-H.svg)
![5-Chloro-3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-2-oxidobenzenesulfonate, chromium(3+), hydron, 2-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-5-nitrophenolate chemical structure, C32H23ClCrN9O9S, CAS 73003-26-6](/s/WBIKSKDQZIJBNC-UHFFFAOYSA-K.svg)
![Bis[5-chloro-2-(hydroxy-kappaO)-3-{[3-methyl-5-(oxo-kappaO)-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl]diazenyl-kappaN1}benzenesulfonato(3-)]chromate(3-) chemical structure, C32H20Cl2CrN8O10S2-3, CAS 765846-25-1](/s/KDSYIFVDWLFLQS-UHFFFAOYSA-H.svg)
![Bis(5-chloro-3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-2-oxidobenzenesulfonate), chromium(3+), hydron chemical structure, C32H23Cl2CrN8O10S2](/s/KDSYIFVDWLFLQS-UHFFFAOYSA-K.svg)
![Chromium(3+), hydron, 2-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]benzoate, 5-nitro-2-oxido-3-[(2-oxidonaphthalen-1-yl)diazenyl]benzenesulfonate chemical structure, C33H22CrN7O10S, CAS 72987-00-9](/s/MPXKGZSKUGWSMG-UHFFFAOYSA-K.svg)
![Sodium, chromium, hydron, 2-hydroxy-3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-5-nitrobenzenesulfonate, 4-[(2-hydroxy-4-nitrophenyl)diazenyl]-5-methyl-2-phenylpyrazol-1-id-3-one chemical structure, C32H24CrN10NaO11S-, CAS 73513-78-7](/s/WIGSWVLPMPLKON-UHFFFAOYSA-L.svg)
Same formula isomers
Different compounds that share this molecular formula
Frequently asked questions
Quick answers about Acidorange74, based on the data on this page
What is Acidorange74?
What is the molecular formula and weight of Acidorange74?
Is Acidorange74 hazardous?
What is the HS code of Acidorange74?
Where can I buy Acidorange74?
What is the price of Acidorange74?
Guides for buyers
Practical guides that help when you source, ship or handle Acidorange74
- 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
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
Get quotes for Acidorange74
Embed this structure on your websiteShow code
Paste this code into your page to show the 2D structure of Acidorange74 with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.
<iframe src="https://www.compoundlist.com/embed/structure/acidorange74-cid-138394372" title="Acidorange74 structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>Explore more in Heterocyclic compounds or HS code 293319