Clomipramine

Description

Clomipramine · CAS 303-49-1 · C19H23ClN2. UNII NUV44L116D. Boiling Point: 160-170 °C at 3.00E-01 mm Hg; Boiling Point: 160-170 °C at 0.3 mm Hg; Melting Point: 191.5-192.

Identification

CAS Registry Number	303-49-1
PubChem CID	2801
Molecular formula	C19H23ClN2
IUPAC name	3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine
UNII (FDA)	NUV44L116D

Computed Descriptors

Molecular Weight	314.9
XLogP3	5.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	314.1549764
Monoisotopic Mass	314.1549764
Topological Polar Surface Area	6.5
Heavy Atom Count	22
Formal Charge	0

Physical & Chemical Properties

Boiling Point	160-170 °C at 3.00E-01 mm Hg
Boiling Point	160-170 °C at 0.3 mm Hg
Melting Point	191.5-192
Melting Point	189.5 °C
Solubility	0.294
Solubility	1.44e-02 g/L
LogP	5.19
LogP	log Kow = 5.19
LogP	4.5
Dissociation Constants	9.38

Physical description & handling notes

• Solid
• 174.5 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID3042633]
• 174.5 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID3042633]
• 174.3 Ų [M+H]+ [CCS Type: TW; Method: Major Mix IMS/Tof Calibration Kit (Waters)]
• 174.4 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated]
• 172.14 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

GHS Hazard Classification

Reported hazard statements	H302 (100%)

Documented Uses

• THERAP CAT: Antidepressant, antiobsessional agent
• THERAP CAT (VET): In treatment of canine separation anxiety
• Use (kg; approx.) in Germany (2009): >1000
• Consumption (g per capita; approx.) in Germany (2009): 0.0122
• May be used to treat obsessive-compulsive disorder and disorders with an obsessive-compulsive component (e.g. depression, schizophrenia, Tourette's disorder). Unlabeled indications include: depression, panic disorder, chronic pain (e.g. central pain, idiopathic pain disorder, tension headache, diabetic peripheral neuropathy, neuropathic pain), cataplexy and associated narcolepsy (limited evidence), autistic disorder (limited evidence), trichotillomania (limited evidence), onchophagia (limited evidence), stuttering
• Preparation: ... W. Schindler, H. Dietrich, CH 371799; eidem, US 3467650 (1963, 1969 both to Geigy).

Synonyms

clomipramine; Chlorimipramine; 303-49-1; Monochlorimipramine; 3-Chloroimipramine; Hydiphen; Clomicalm; Clomipramina; Clomipraminum; Anapramine; 5H-Dibenz[b,f]azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-; 3-Chloro-Iminodibenzyl; DTXSID6022844; 3-Chloro-5-(3-(dimethylamino)propyl)-10,11-dihydro-5H-dibenz(b,f)azepine; NSC-169865; NUV44L116D

Frequently Asked Questions

What are the CAS number and molecular formula of Clomipramine?

CAS 303-49-1; molecular formula C19H23ClN2; molecular weight — g/mol.

What other names is Clomipramine known by?

clomipramine, Chlorimipramine, 303-49-1, Monochlorimipramine, 3-Chloroimipramine, Hydiphen.

Is Clomipramine classified as hazardous?

Hazard statements reported: H302.

What are the key physical properties of Clomipramine?

Boiling Point: 160-170 °C at 3.00E-01 mm Hg; Boiling Point: 160-170 °C at 0.3 mm Hg; Melting Point: 191.5-192; Melting Point: 189.5 °C.

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.