ertapenem

CAS 153832-46-3C22H25N3O7SMW 475.5

ertapenem (CAS 153832-46-3) — formula C22H25N3O7S, molecular weight 475.5.

Product Overview

CAS Number	153832-46-3
Molecular Formula	C22H25N3O7S
Molecular Weight	475.5
Melting Point	230-234
LogP	0.3
Applications	Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >75, Consumption (g per capita, approx.) in Germany (2009): 0.000916, Excretion rate: 0.3, Calculated removal (%): 22, Methods of Manufacturing: Preparation: M. J. Betts et al., WO 9315078, eidem, US 5478820 (1993, 1995 both to Zeneca), Formulations, Preparations: Table: Ertapenem Sodium Preparations [Table#7965]

Applications

Documented applications: Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >75, Consumption (g per capita, approx.) in Germany (2009): 0.000916, Excretion rate: 0.3, Calculated removal (%): 22, Methods of Manufacturing: Preparation: M. J. Betts et al., WO 9315078, eidem, US 5478820 (1993, 1995 both to Zeneca), Formulations, Preparations: Table: Ertapenem Sodium Preparations [Table#7965].

Technical Profile

What this product is

ertapenem is a chemical compound with CAS registry number 153832-46-3 and molecular formula C22H25N3O7S (molecular weight 475.5).

Identification

CAS number: 153832-46-3

Its molecular formula C22H25N3O7S comprises 22 C, 25 H, 3 N, 7 O, 1 S atoms.

Also known as: ertapenem · 厄他培南

Frequently Asked Questions

What is the CAS number of ertapenem?

The CAS registry number of ertapenem is 153832-46-3.

What is the molecular formula and molecular weight of ertapenem?

Molecular formula C22H25N3O7S, molecular weight 475.5.

What other names is ertapenem known by?

It is also registered under: ertapenem, 厄他培南.

What are the documented applications of ertapenem?

Recorded applications: Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >75, Consumption (g per capita, approx.) in Germany (2009): 0.000916, Excretion rate: 0.3, Calculated removal (%): 22, Methods of Manufacturing: Preparation: M. J. Betts et al., WO 9315078, eidem, US 5478820 (1993, 1995 both to Zeneca), Formulations, Preparations: Table: Ertapenem Sodium Preparations [Table#7965].

PubChem Public Data

Independent reference data for ertapenem (CAS 153832-46-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number	153832-46-3
PubChem CID	150610
Molecular formula	C22H25N3O7S
IUPAC name	(4R,5S,6S)-3-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
UNII (FDA)	G32F6EID2H

Computed descriptors

Molecular Weight	475.5
XLogP3	-1.5
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	7
Exact Mass	475.14132132
Monoisotopic Mass	475.14132132
Topological Polar Surface Area	182
Heavy Atom Count	33

Physicochemical values on record

Melting Point	230-234
Solubility	2.86e-01 g/L
LogP	0.3

Documented uses on record

Synonyms and trade names

Ertapenem; 153832-46-3; G32F6EID2H; CHEBI:404903; DTXSID50165456; ertapenemum; RefChem:56902; DTXCID0087947; J01DH03; 836-232-1; Invanz; Ertapenem [INN]; Ertapenem (INN); Invanz (TN); ertapenem hydrochloride; MK-826

GHS hazard classification

Reported hazard statements	H334 (97.2%), H400 (97.2%), H411 (97.2%)

H334 (97.2%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]

H400 (97.2%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

What the public record says

ertapenem · CAS 153832-46-3 · C22H25N3O7S. UNII G32F6EID2H. Melting Point: 230-234; Solubility: 2.86e-01 g/L; LogP: 0.3.

Physical description and handling notes

Source: PubChem / Wikidata; the batch COA governs where values differ.