Sultamicillin tosylate

Basic Information

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CAS Number

83105-70-8

Molecular Formula

C32H38N4O12S3

Molecular Weight

766.87 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

129-165°C

Boiling Point

907.7ºC at 760 mmHg

Density

1.55

Flash Point

502.8ºC

Refractive Index

1.668

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)O.CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)OCOC(=O)C4C(S(=O)(=O)C5N4C(=O)C5)(C)C)C

InChI

InChI=1S/C25H30N4O9S2.C7H8O3S/c1-24(2)17(29-20(32)16(21(29)39-24)27-19(31)15(26)12-8-6-5-7-9-12)22(33)37-11-38-23(34)18-25(3,4)40(35,36)14-10-13(30)28(14)18;1-6-2-4-7(5-3-6)11(8,9)10/h5-9,14-18,21H,10-11,26H2,1-4H3,(H,27,31);2-5H,1H3,(H,8,9,10)/t14-,15-,16-,17+,18+,21-;/m1./s1

InChIKey

FFCSPKNZHGIDQM-CGAOXQFVSA-N

LogP

0.6531200000000048

Topological Polar Surface Area

236.84999999999997 Å²

Hydrogen Bond Donor/Acceptor

4 / 16

Complexity

1450

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Unacim orale
DTXCID2028567
CP 49952 p-Toluenesulfonate
UNII-46940LU8EO
CHEMBL3183856
[(2S,5R)-3,3-dimethyl-4,4,7-trioxo-4lambda6-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl]oxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;4-methylbenzenesulfonic acid
(((2S,5R,6R)-6-((R)-2-Amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl)oxy)methyl(2S,5R)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate4,4-dioxide4-methylbenzenesulfonate
DTXSID9048641
Sultamicillin tosilate [JAN]
Bacimex
AC-4506
SULTAMICILLIN TOSYLATE
SULTAMICILLIN TOSYLATE [MI]
Unacid PD oral
AKOS015963377
U0097
(((2S,5R,6R)-6-((R)-2-Amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carbonyl)oxy)methyl (2S,5R)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 4,4-dioxide 4-methylbenzenesulfonate
SULTAMICILLIN TOSILATE [WHO-DD]
83105-70-8
CHEBI:32170
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid,6-[[(2R)-aminophenylacetyl]amino]-3,3-dimethyl-7-oxo-,[[[(2S,6R)-3,3-dimethyl-4,4-dioxido-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-yl]carbonyl]oxy]methylester,(2S,5R,6R)-,(4-methylbenzenesulfonate)(1:1)
DS-3314
Sbtpc
46940LU8EO
VD 1827 p-Toluenesulfonate
Q27114807
Sultamicillin tosilate
CAS-83105-70-8
Tox21_112990
Unacim
SCHEMBL10568567

MDL Number

MFCD01682151

Customs Code

2941101900

FAQ

What is Sultamicillin tosylate (CAS: 83105-70-8)?

Sultamicillin tosylate is an antibiotic compound used in pharmaceutical applications. It has the chemical formula C17H21N3O7S2 and is known for its broad-spectrum activity against bacterial infections. As a derivative of sultamicillin, it is commonly used as an intermediate in drug synthesis and is characterized by its solubility in water and stability under standard conditions.

What are the main uses of Sultamicillin tosylate (CAS: 83105-70-8)?

Sultamicillin tosylate is primarily used in the pharmaceutical industry as an intermediate for producing antibiotics. It is also applied in veterinary medicine for treating bacterial infections in animals. Its utility extends to research settings for developing new antimicrobial agents and to industrial applications where antibiotic compounds are required for manufacturing or processing.

Is Sultamicillin tosylate (CAS: 83105-70-8) safe?

Sultamicillin tosylate is generally considered safe when used as directed. However, proper handling is essential to avoid exposure, especially in laboratory or industrial environments. Safety standards recommend using protective equipment such as gloves and goggles, and following guidelines for chemical waste disposal to ensure minimal risk to health and the environment.

How should Sultamicillin tosylate (CAS: 83105-70-8) be stored?

Sultamicillin tosylate should be stored in a cool, dry place away from direct light. The recommended temperature range is between 15°C to 25°C, and it should be kept in a sealed, airtight container to maintain its stability. Avoid exposure to moisture and ensure storage conditions comply with safety and regulatory standards.