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tert-butyl 4-(4-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate - 95%, high purity , CAS No.234082-33-8

COA

Grade & Purity:

≥95%

Cas Number: 234082-33-8
Molecular Weight: 334.42
PubChem CID: 11709764
PubChem SID: 504766661

In stock

Item Number

T303146

Grouped product items
SKU	Size	Availability	Price
T303146-100mg	100mg	3	$11.90
T303146-500mg	500mg	3	$48.90
T303146-1g	1g	3	$80.90
T303146-5g	5g	3	$280.90

Basic Description

Synonyms	234082-33-8 \| tert-Butyl 4-(4-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate \| Ethyl 4-(4-BOC-piperazino)benzoate \| Tert-butyl 4-(4-ethoxycarbonylphenyl)piperazine-1-carboxylate \| MFCD09031688 \| TERT-BUTYL 4-[4-(ETHOXYCARBONYL)PHENYL]PIPERAZINE-1-CARBOXYLATE \| AB339
Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazinanes
    - Subclass Piperazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazinanes
Subclass	Piperazines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpiperazines
Alternative Parents	N-arylpiperazines Benzoic acid esters Aminobenzoic acids and derivatives Piperazine carboxylic acids Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines Carbamate esters Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpiperazine - N-arylpiperazine - Aminobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Piperazine-1-carboxylic acid - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504766661
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504766661
IUPAC Name	tert-butyl 4-(4-ethoxycarbonylphenyl)piperazine-1-carboxylate
INCHI	InChI=1S/C18H26N2O4/c1-5-23-16(21)14-6-8-15(9-7-14)19-10-12-20(13-11-19)17(22)24-18(2,3)4/h6-9H,5,10-13H2,1-4H3
InChIKey	SBIWRFCYFYWFLT-UHFFFAOYSA-N
Smiles	CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C
Isomeric SMILES	CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C
PubChem CID	11709764
Molecular Weight	334.42

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
C2511368	Certificate of Analysis	Oct 21, 2022	T303146
L2207927	Certificate of Analysis	Oct 21, 2022	T303146
L22071022	Certificate of Analysis	Oct 21, 2022	T303146
L22071020	Certificate of Analysis	Oct 21, 2022	T303146
L22071019	Certificate of Analysis	Oct 21, 2022	T303146

Chemical and Physical Properties

Boil Point(°C)	463.7±40.0 °C(Predicted)
Molecular Weight	334.400 g/mol
XLogP3	2.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	334.189 Da
Monoisotopic Mass	334.189 Da
Topological Polar Surface Area	59.100 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	431.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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