5H-Pyrido(4,3-b)indole-8-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, hydrochloride
Basic information
- CAS
40431-45-6- Standard SMILES
CN1CCc2[nH]c3ccc(C(=O)O)cc3c2C1.Cl- InChIKey
ULUFFFPURQWXJJ-UHFFFAOYSA-N- Molecular formula
- C13H15ClN2O2
- Average molar mass
- 266.72 g/mol
- Monoisotopic mass
- 266.0822054
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indole-8-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, hydrochloride
- IUPAC
- 2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid;hydrochloride
- English name
- 2-Methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]-indole-8-carboxylic acid hydrochloride
- Molecular formula
- C13H15ClN2O2
- Molecular weight
- 266.7234
Names & synonyms
40431-45-65H-Pyrido(4,3-b)indole-8-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, hydrochloride8-Carboxy-2-methyl-1,2,3,4-tetrahydro-gamma-carboline hydrochlorideDTXSID501934511,2,3,4-Tetrahydro-2-methyl-5H-pyrido(4,3-b)indole-8-carboxylic acid hydrochloride2-METHYL-1H,2H,3H,4H,5H-PYRIDO[4,3-B]INDOLE-8-CARBOXYLIC ACID HYDROCHLORIDE2-methyl-1H,2H,3H,4H,5H-pyrido(4,3-b)indole-8-carboxylic acid hydrochlorideRefChem:538296DTXCID60115942856-894-52-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-carboxylic acid hydrochlorideMFCD01690519
Show more names
2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid,hydrochloride
2-Methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]-indole-8-carboxylic acid hydrochloride2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid;hydrochloride2-methyl-2,3,4,5-tetrahydro-1h-pyrido[4,3-b]indole-8-carboxylic acid hydrochloride(1:1)AKOS015846515SY198335EN300-222121F74782F366730
Database identifiers
- CAS
40431-45-6- PubChem CID
- 218281
- DTXSID
DTXSID50193451- EC Number
- 856-894-5
Properties
Computed structural properties
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- 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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Related reactions
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Compound notes
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