Pentazocine lactate

Base Information

• Chemical Name: Pentazocine lactate
• CAS No.: 17146-95-1
• Deprecated CAS: 22242-36-0,22242-37-1,94293-50-2
• Molecular Formula: C19H27NO•C3H6O3
• Molecular Weight: 375.56
• European Community (EC) Number: 241-209-9
• UNII: 1P2XIB510O
• DSSTox Substance ID: DTXSID101027503
• NCI Thesaurus Code: C76851
• ChEMBL ID: CHEMBL1200327
• Mol file: 17146-95-1.mol

Synonyms:Fortral;Hydrochloride, Pentazocine;Lactate, Pentazocine;Lexir;Pentazocine;Pentazocine Hydrochloride;Pentazocine Lactate;Talwin

Chemical Property of Pentazocine lactate

Chemical Property:

• Vapor Pressure: 7.06E-13mmHg at 25°C
• Melting Point: 145.4-147.2oC
• Boiling Point: 548.8°C at 760 mmHg
• Flash Point: 285.7°C
• PSA: 49.77000
• LogP: 3.40110
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 375.24095853
• Heavy Atom Count: 27
• Complexity: 473

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): A poison. A human skin irritant.
• Hazard Codes: A poison. A human skin irritant.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C2CC3=C(C1(CCN2CC=C(C)C)C)C=C(C=C3)O.CC(C(=O)O)O
• Isomeric SMILES: C[C@H]1[C@H]2CC3=C([C@@]1(CCN2CC=C(C)C)C)C=C(C=C3)O.CC(C(=O)O)O