Carbamylcholine

Base Information

• Chemical Name: Carbamylcholine
• CAS No.: 462-58-8
• Molecular Formula: C6H15N2O2+
• Molecular Weight: 0
• Hs Code.: 2924199090
• UNII: 54Z8M50D6Q
• DSSTox Substance ID: DTXSID0048397
• Nikkaji Number: J2.049D
• Wikidata: Q27458733
• RXCUI: 1546387
• Pharos Ligand ID: RCRXFUJC8CK2
• Metabolomics Workbench ID: 145152
• ChEMBL ID: CHEMBL965
• Mol file: 462-58-8.mol

Synonyms:Carbachol;Carbachol, Isopto;Carbacholine;Carbamann;Carbamoylcholine;Carbamylcholine;Carbastat;Carbocholine;Carboptic;Doryl;Isopto Carbachol;Jestryl;Miostat

Chemical Property of Carbamylcholine

Chemical Property:

• Melting Point: 200-203oC, some decomposition
• PSA: 53.31000
• LogP: 0.30170
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 147.113352725
• Heavy Atom Count: 10
• Complexity: 117

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+](C)(C)CCOC(=O)N

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