2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole hydrochloride
Basic information
- CAS
20522-30-9- Standard SMILES
Cl.c1ccc2c3c([nH]c2c1)CCNC3- InChIKey
VNAOGYKTNRGMRR-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2
- Average molar mass
- 208.69 g/mol
- Monoisotopic mass
- 208.0767261
Overview
See also: 1H,2H,3H,4H,5H-pyrido(4,3-b)indole hydrochloride (annotation moved to).
Names & identifiers
- Preferred name
- 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole hydrochloride
- IUPAC
- 2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole;hydrochloride
- English name
- 2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole hydrochloride
- Molecular formula
- C11H13ClN2
- Molecular weight
- 208.69
Names & synonyms
2,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole hydrochloride20522-30-9MFCD087033072,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indolehydrochloride2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole;hydrochlorideSMR000559186SR-010005307652,3,4,5-Tetrahydro-1H-pyrido[4,3-b]indole--hydrogen chloride (1/1)1H,2H,3H,4H,5H-pyrido[4,3-b]indole hydrochlorideSCHEMBL2243782CHEMBL1511717SCHEMBL30741597
Show more names
ETHYL 3,4-DIHYDRO-1H-PYRIDO[4,3-B]INDOLE-2(5H)-CARBOXYLATE1H-PYRIDO[4,3,B]INDOLE, 2,3,4,5-TETRAHYDRO MONOHYDROCHLORIDE
DTXSID90468756VNAOGYKTNRGMRR-UHFFFAOYSA-NAKOS015844751EBC-367057BS-35814CS-0316359VU0137813-4F361003
Database identifiers
- CAS
20522-30-9- PubChem CID
- 11572011
- DTXSID
DTXSID90468756
Properties
Computed structural properties
- Topological polar surface area
- 27.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 193
Experimental & physicochemical properties
Solubility>31.3 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 230 °C · >230 °C(Solv: ethanol (64-17-5))
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
1 records
Compound notes
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