Cefaclor monohydrate
Also known as Cefaclor (monohydrate), (6R,7R)-7-((R)-2-amino-2-phenylacetamido)-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate, 3-Chloro-7-D-(2-phenylglycinamido)-3-cephem-4-carboxylic acid monohydrate
Key facts
What buyers check first
- CAS number
- 70356-03-5
- Formula
- C15H16ClN3O5S
- Molar mass
- 385.83 g/mol
- EC number
- 641-991-5
- HS code
- 294190
- Category
- Screening compounds
What is Cefaclor monohydrate?
Plain description, key identifiers and synonyms
Cefaclor monohydrate is a chemical substance with the molecular formula C15H16ClN3O5S and a molar mass of 385.83 g/mol. Its CAS registry number is 70356-03-5. The IUPAC name is (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, hydrate.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, hydrate
- CAS number
- 70356-03-5 CAS number cross-checked
- EC number
- 641-991-5
- Molecular formula
- C15H16ClN3O5S
- UNII
- 69K7K19H4L
- MDL number
- MFCD00071999
- InChIKey
- WKJGTOYAEQDNIA-IOOZKYRYSA-N
- InChI
- InChI=1S/C15H14ClN3O4S.H2O/c16-8-6-24-14-10(13(21)19(14)11(8)15(22)23)18-12(20)9(17)7-4-2-1-3-5-7;/h1-5,9-10,14H,6,17H2,(H,18,20)(H,22,23);1H2/t9-,10-,14-;/m1./s1
- Canonical SMILES
- NC(C(=O)NC1C(=O)N2C(C(=O)O)=C(Cl)CSC12)c1ccccc1.O
- Isomeric SMILES
- C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)Cl.O
Synonyms
- Cefaclor (monohydrate)
- (6R,7R)-7-((R)-2-amino-2-phenylacetamido)-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate
- 3-Chloro-7-D-(2-phenylglycinamido)-3-cephem-4-carboxylic acid monohydrate
- Alfatil
- Kefolor
- Panacef
- Alfatil Kapseln
- Muco Panoral
- Kefolor Suspension
- (6R,7R)-7-((R)-2-Amino-2-phenylacetamido)-3-chloro-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid monohydrate
- Lilly 99638 hydrate
- (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, hydrate
- C15H16ClN3O5S
- Compo
- Di staclor
- 70356-03-5 (hydrate)
- Cefaclor (USP)
- (6R,7R)-7-[(R)-2-Amino-2-phenylacetamido]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid monohydrate
- (6R,7R)-7-[[(2R)-2-Amino-2-phenylacetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid monohydrate
- Ceclor (TN)
- Cefaclor
- (6R,7R)-7-[(2-Amino-2-phenylacetyl)amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid Monohydrate
- (6R,7R)-7-[(2R)-2-amino-2-phenylacetamido]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate
- (6R,7R)-7-[[(2R)-2-amino-2-phenyl-acetyl]amino]-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, hydrate
- (6R,7R)-7-{[(2R)-2-Amino-1-hydroxy-2-phenylethylidene]amino}-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid--water (1/1)
Show all 26 synonymsShow fewer synonyms
- 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((aminophenylacetyl)amino)-3-chloro-8-oxo-, monohydrate, (6r-(6alpha,7beta(r*)))-
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 | 385.83 g/molcalc.Computed value |
|---|---|
| Exact mass | 385.0499 Dacalc.Computed value |
| LogP (octanol/water) | -0.2calc.Computed value |
| Topological polar surface area | 144.2 Ųcalc.Computed value |
| Hydrogen bond donors | 3calc.Computed value |
| Hydrogen bond acceptors | 5calc.Computed value |
| Rotatable bonds | 4calc.Computed value |
| Heavy atoms | 25calc.Computed value |
| Rings | 3calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.27calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 3calc.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
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 aidCefaclor monohydrate suppliers
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- ChinaUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- China, Shangyu ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- Italy, Albano Sant'Alessandro (BG) ManufacturerUnclaimed profileCefaclor monohydrateGrade, purity and minimum order on requestPrice on request
- Pakistan, Karachi ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- Bangladesh, Dhaka ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- Bangladesh, Dhaka ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- South Korea ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- Italy, Albano Sant'Alessandro (BG) ManufacturerUnclaimed profileCefaclor MonohydrateGrade, purity and minimum order on requestPrice on request
- United States, San DiegoUnclaimed profileCefaclor monohydrateGrade, purity and minimum order on requestPrice on request
- China, NanjingUnclaimed profileCefaclor monohydrateGrade, purity and minimum order on requestPrice on request
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15 suppliers in 6 countries
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Cefaclor monohydrate price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Industries and functions
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 Cefaclor monohydrate is traded under.
Antibiotics, other
- China39.7%
- United States11.3%
- Switzerland * partner reported10.9%
* Partner reported figures, a lower bound.
The HS code shown for Cefaclor monohydrate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Cefaclor monohydrate, based on the data on this page
What is Cefaclor monohydrate?
What is the CAS number of Cefaclor monohydrate?
What is the molecular formula and weight of Cefaclor monohydrate?
What is Cefaclor monohydrate used for?
Is Cefaclor monohydrate hazardous?
What is the HS code of Cefaclor monohydrate?
Where can I buy Cefaclor monohydrate?
What is the price of Cefaclor monohydrate?
Guides for buyers
Practical guides that help when you source, ship or handle Cefaclor monohydrate
- 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
- 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
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