哈莫尔

Description

harmol · CAS 487-03-6 · C12H10N2O. UNII 7PQ075MCA6. LogP: 2.18.

Identification

CAS Registry Number	487-03-6
PubChem CID	68094
Molecular formula	C12H10N2O
IUPAC name	1-methyl-2,9-dihydropyrido[3,4-b]indol-7-one
UNII (FDA)	7PQ075MCA6

Computed Descriptors

Molecular Weight	198.22
XLogP3	0.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	198.079312947
Monoisotopic Mass	198.079312947
Topological Polar Surface Area	41.1
Heavy Atom Count	15
Formal Charge	0

Physical & Chemical Properties

LogP	2.18

Physical description & handling notes

• 145.76 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
• 138.64 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
• 134.33 Ų [M+H-H2O]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
• 148.8 Ų [M+K]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
• 138.99 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Documented Uses

• 6-Hydroxyharmaline has known human metabolites that include Harmol glucuronide and Harmol sulfate.
• 6-Hydroxy-harmaline is a known human metabolite of harmine.

Synonyms

Harmol; 487-03-6; 1-methyl-9H-pyrido[3,4-b]indol-7-ol; 9H-Pyrido[3,4-b]indol-7-ol, 1-methyl-; 1-Methyl-9H-beta-carbolin-7-ol; 1-methyl-2,9-dihydropyrido[3,4-b]indol-7-one; MFCD00834164; NSC 72292; MLS000736795; 1-methylbeta-carbolin-7-ol; 1-Methyl-9H-pyrido(3,4-b)indol-7-ol; CHEMBL14285; 7PQ075MCA6; NSC-72292; SMR000528328; 9H-Pyrido(3,4-b)indol-7-ol, 1-methyl-

Frequently Asked Questions

What are the CAS number and molecular formula of harmol?

CAS 487-03-6; molecular formula C12H10N2O; molecular weight — g/mol.

What other names is harmol known by?

Harmol, 487-03-6, 1-methyl-9H-pyrido[3,4-b]indol-7-ol, 9H-Pyrido[3,4-b]indol-7-ol, 1-methyl-, 1-Methyl-9H-beta-carbolin-7-ol, 1-methyl-2,9-dihydropyrido[3,4-b]indol-7-one.

What are the key physical properties of harmol?

LogP: 2.18.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.