1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid

CAS Number: 85098-64-2

Molecular Formula: C19H22N2O2

Purity: 1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid 98% purity

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About 1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid

1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid (CAS 85098-64-2) is a critical precursor in the US API intermediates market, where Pharma/API purity 99% is essential for the custom synthesis of advanced analgesics and fentanyl-related derivatives. 4-Anilino-1-benzylpiperidine-4-carboxylic acid serves as a high pur...

Synonyms

85098-64-2
1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid
4-Anilino-1-benzyl-4-piperidinecarboxylic acid
4-anilino-1-benzylpiperidine-4-carboxylic acid
NSC73748

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1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid Specifications

CAS Number

85098-64-2

Molecular Formula

C19H22N2O2

Molecular Weight

310.4 g/mol

IUPAC Name

4-anilino-1-benzylpiperidine-4-carboxylic acid

Canonical SMILES

C1CN(CCC1(C(=O)O)NC2=CC=CC=C2)CC3=CC=CC=C3

InChI Key

YFSCBWDAVTYIMM-UHFFFAOYSA-N

InChI

InChI=1S/C19H22N2O2/c22-18(23)19(20-17-9-5-2-6-10-17)11-13-21(14-12-19)15-16-7-3-1-4-8-16/h1-10,20H,11-15H2,(H,22,23)

PubChem CID

43544

EINECS Number

285-415-7

MDL Number

MFCD00023753

HSN No

29333990

CAS Number

85098-64-2

Molecular Formula

C19H22N2O2

Molecular Weight

310.4 g/mol

IUPAC Name

4-anilino-1-benzylpiperidine-4-carboxylic acid

Canonical SMILES

C1CN(CCC1(C(=O)O)NC2=CC=CC=C2)CC3=CC=CC=C3

InChI Key

YFSCBWDAVTYIMM-UHFFFAOYSA-N

InChI

InChI=1S/C19H22N2O2/c22-18(23)19(20-17-9-5-2-6-10-17)11-13-21(14-12-19)15-16-7-3-1-4-8-16/h1-10,20H,11-15H2,(H,22,23)

PubChem CID

43544

EINECS Number

285-415-7

MDL Number

MFCD00023753

HSN No

29333990

Molecular Weight

310.4 g/mol

Purity

1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid 98% purity

Melting Point

239-241°C

Boiling Point

497.8±45.0 °C (Predicted)

Freezing point

239-241°C

Flash Point

254.9 °C

Density

1.234 g/cm3

Precise Quality

85098-64-2

PSA

52.6 Å²

logP

1.1

Average mass

310.39 g/mol

Monoisotopic mass

310.168127949 Da

Molar mass

310.39 g/mol

Precautionary Statement Codes

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

Acute Tox. 4 (100%) Skin Irrit. 2 (100%)

Pharmaceutical Intermediate

A critical organic building block utilized as a precursor in the synthesis of norcarfentanil and various other fentanyl analogues for medicinal research

Analgesic Research Compound

A piperidine derivative employed in the study and development of potential multitarget analgesic agents with high affinity for mu-opioid receptors

Analytical Reference Standard

A regulated precursor and functionalized intermediate used in forensic applications and academic research for the characterization of complex opioid-related molecules.