Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)

Basic Information

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CAS Number

54-35-3

Molecular Formula

C29H38N4O6S

Molecular Weight

570.7 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

Boiling Point

663.3°C at 760 mmHg

Flash Point

355°C

Refractive Index

1.6000 (estimate)

Vapor Pressure

1.69E-18mmHg at 25°C

SMILES

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CCN(CC)CCOC(=O)C1=CC=C(C=C1)N.CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C16H18N2O4S.C13H20N2O2/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);5-8H,3-4,9-10,14H2,1-2H3/t11-,12+,14-;/m1./s1

InChIKey

WHRVRSCEWKLAHX-LQDWTQKMSA-N

LogP

3.53820

Complexity

752

Synonyms & References

English

Penicillin procaine
Procaine benzylpenicillinate
Penicillin Procaine Anhydrous
DB09320
Procaine penicillin G
Micro-Pen
1LW5K9CIR1
LS-149840
Nopcaine
Hydracillin
C16-H18-N2-O4-S.C13-H20-N2-O2
s4979
E707
UNII-1LW5K9CIR1
Penzal N 300
PENICILLIN G PROCAINE ANHYDROUS
HY-130079
Duphapen
Benzilpenillina procainica
WHRVRSCEWKLAHX-LQDWTQKMSA-N
EINECS 200-205-7
CS-0104860
AKOS015896161
EN300-19736966
DTXSID30883227
Depocillin
Procainebenzylpenicillin
Penicillin procaine anhydrous [USAN]
CHEMBL1628385
Penicillin G Procaine (anhydrous)
Vitablend

MDL Number

MFCD00079285

Customs Code

2941109900

FAQ

What regulatory guidelines apply to CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1))?

CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) falls under the scope of the Chemicals of Very High Concern (vCPCs) list under REACH and may require authorization if it meets the criteria. Additionally, it is also subject to GHS (Globally Harmonized System of Classification and Labeling of Chemicals) classification. For FDA and EPA requirements, it would fall under the general provisions for pharmaceutical and chemical products, including registration, labeling, and environmental management.

Are there alternatives to CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) in synthesis?

There are several alternatives to CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) in synthesis, such as other amino acid derivatives or similar cyclic compounds. Common alternative reagents include various protected amino acids and their derivatives, which can serve similar functions in chemical reactions. However, the choice of alternative should be evaluated based on the specific reaction conditions and desired product properties.

What is the market or research trend for CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1))?

The market for CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) is primarily driven by pharmaceutical and research applications. Recent trends indicate an increasing focus on personalized medicine and new drug discovery, which may drive demand for this compound. Research is also exploring its potential in areas such as anti-inflammatory and antiviral applications. The price and availability are influenced by these factors and ongoing research developments.

How should waste containing CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) be handled?

Waste containing CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) should be collected and stored in a closed, labeled container. The waste should be handled according to the waste management guidelines under REACH and the GHS. Incineration or professional waste disposal services are recommended to ensure environmental protection. Proper disposal involves neutralizing any acidic or basic components before incineration and following local environmental regulations.

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

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Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

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Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

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Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1) | CAS No. 54-35-3

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Flash Point

Refractive Index

Vapor Pressure

Chemical Properties

SMILES

InChI

InChIKey

LogP

Complexity

Synonyms & References

English

MDL Number

Customs Code

FAQ

What regulatory guidelines apply to CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1))?

Are there alternatives to CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) in synthesis?

What is the market or research trend for CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1))?

How should waste containing CAS 54-35-3 (Hydrogen (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate - 2-(diethylamino)ethyl 4-aminobenzoate (1:1:1)) be handled?

Related Compounds

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