Basic information
- CAS
299438-96-3- Standard SMILES
Cc1[nH]c2c(Cl)ccc(Cl)c2c1CCN- InChIKey
HTUUKBBIGLELJY-UHFFFAOYSA-N- Molecular formula
- C11H12Cl2N2
- Average molar mass
- 243.13 g/mol
- Monoisotopic mass
- 242.0377538
Names & identifiers
- Preferred name
- 2-(4,7-dichloro-2-methyl-1H-indol-3-yl)ethan-1-amine
- IUPAC
- 2-(4,7-dichloro-2-methyl-1H-indol-3-yl)ethanamine
Names & synonyms
299438-96-32-(4,7-dichloro-2-methyl-1H-indol-3-yl)ethan-1-amineRefChem:456043865-611-42-(4,7-dichloro-2-methyl-1H-indol-3-yl)ethanamine2-(4,7-Dichloro-2-methylindol-3-yl)ethylamine hydrochloride2-(4,7-dichloro-2-methylindol-3-yl)ethylamineOprea1_440249SCHEMBL3216180SBB012638STK117826AKOS005400066
Show more names
EBC-612428ST038836EN300-5621716Z32261116342-(4,7-dichloro-2-methyl-1H-indol-3-yl)ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
299438-96-3- PubChem CID
- 729232
- EC Number
- 865-611-4
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
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, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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