Daptomycin impurity 55
Key facts
What buyers check first
- CAS number
- 88399-21-7
- Formula
- C15H16ClN3O2
- Molar mass
- 305.77 g/mol
- HS code
- 292529
- Category
- Impurities and reference standards
What is Daptomycin impurity 55?
Plain description, key identifiers and synonyms
Daptomycin impurity 55 is a chemical substance with the molecular formula C15H16ClN3O2 and a molar mass of 305.77 g/mol. Its CAS registry number is 88399-21-7. The IUPAC name is (4-carbamimidoylphenyl) 2-amino-5-methylbenzoate, hydrochloride.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (4-carbamimidoylphenyl) 2-amino-5-methylbenzoate, hydrochloride
- CAS number
- 88399-21-7
- Molecular formula
- C15H16ClN3O2
- InChIKey
- JIGPPRAOFHVKQD-UHFFFAOYSA-N
- InChI
- InChI=1S/C15H15N3O2.ClH/c1-9-2-7-13(16)12(8-9)15(19)20-11-5-3-10(4-6-11)14(17)18;/h2-8H,16H2,1H3,(H3,17,18);1H
- SMILES (canonical and isomeric)
- CC1=CC(=C(C=C1)N)C(=O)OC2=CC=C(C=C2)C(=N)N.Cl
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 | 305.77 g/molcalc.Computed value |
|---|---|
| Exact mass | 305.0931 Dacalc.Computed value |
| LogP (octanol/water) | 2.5calc.Computed value |
| Topological polar surface area | 102.2 Ųcalc.Computed value |
| Hydrogen bond donors | 3calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 21calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.07calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Components | 2calc.Computed value |
| Lipinski rule of five | Passes (0 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
O=C(Oc1ccccc1)c1ccccc1
2 rings, 15 atoms, the Phenyl benzoate ring system.
2,426 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.
Daptomycin impurity 55 suppliers
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Post one free request and suppliers who make or trade Daptomycin impurity 55 can send you quotes. Your contact details stay private until you accept a quote.
Daptomycin impurity 55 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 Daptomycin impurity 55 is traded under.
Imines and their derivatives, salts thereof, other
- United States13.3%
- China13.0%
- Brazil9.7%
* Partner reported figures, a lower bound.
The HS code shown for Daptomycin impurity 55 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
Similar structures
Nearest neighbours by Morgan fingerprint Tanimoto similarity
Same formula isomers
Different compounds that share this molecular formula
![4-Chloro-5-[methyl(phenylmethyl)amino]-2-(2-oxopropyl)-3(2H)-pyridazinone chemical structure, C15H16ClN3O2, CAS 860609-87-6](/s/LKCOFMJKMGYEQR-UHFFFAOYSA-N.svg)
![N-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]cyclohexanecarboxamide chemical structure, C15H16ClN3O2, CAS 865287-12-3](/s/JLWCXPHTAIANIH-UHFFFAOYSA-N.svg)
![3-(4-Chlorophenyl)-5-[3-oxo-3-(1-pyrrolidinyl)propyl]-1,2,4-oxadiazole chemical structure, C15H16ClN3O2, CAS 831214-40-5](/s/PXNFMVZKUVLXIH-UHFFFAOYSA-N.svg)
![2-Chloro-4-[(3S,3aS,4S)-4-Hydroxy-3-Methoxy-3a,4,5,6-Tetrahydro-3H-Pyrrolo[1,2-B]pyrazol-2-Yl]-3-Methylbenzonitrile chemical structure, C15H16ClN3O2, CAS 1421375-26-9](/s/RJZJEPYCJHLWQR-TUKIKUTGSA-N.svg)
![2-(4-Chlorophenoxy)-N-{2-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}acetamide chemical structure, C15H16ClN3O2, CAS 1040638-81-0](/s/XZCRAUYLCZLECX-UHFFFAOYSA-N.svg)
![5-Chloro-2-methoxy-N-(2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)benzamide chemical structure, C15H16ClN3O2, CAS 1170833-61-0](/s/SLMPYRCQLMVZMG-UHFFFAOYSA-N.svg)
Frequently asked questions
Quick answers about Daptomycin impurity 55, based on the data on this page
What is Daptomycin impurity 55?
What is the CAS number of Daptomycin impurity 55?
What is the molecular formula and weight of Daptomycin impurity 55?
Is Daptomycin impurity 55 hazardous?
What is the HS code of Daptomycin impurity 55?
Where can I buy Daptomycin impurity 55?
What is the price of Daptomycin impurity 55?
Guides for buyers
Practical guides that help when you source, ship or handle Daptomycin impurity 55
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.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
- 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
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