methyl 6-amino-1H-indole-3-carboxylate
Basic information
- CAS
1249763-34-5- Standard SMILES
COC(=O)c1c[nH]c2cc(N)ccc12- InChIKey
LYNKTDFIPVBZHP-UHFFFAOYSA-N- Molecular formula
- C10H10N2O2
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.07422757
Names & identifiers
- Preferred name
- methyl 6-amino-1H-indole-3-carboxylate
- IUPAC
- methyl 6-amino-1H-indole-3-carboxylate
- English name
- Methyl 6-amino-1H-indole-3-carboxylate
- Molecular formula
- C10H10N2O2
- Molecular weight
- 190.2
Names & synonyms
methyl 6-amino-1H-indole-3-carboxylate1249763-34-5RefChem:817250872-010-0MFCD146221481H-Indole-3-carboxylic acid, 6-amino-, methyl esterSCHEMBL5631381ZZB76334AKOS010564565methyl6-amino-1H-indole-3-carboxylateSB11930AS-34032
Show more names
Methyl 6-aminoindole-3-carboxylatemethyl 6-amino-1H-indole-3-carboxylate - [M17997]
SY212126CS-0048953EN300-311782AMY34199F467601Z802847364
Database identifiers
- CAS
1249763-34-5- PubChem CID
- 61310595
- EC Number
- 872-010-0
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Physicochemical properties
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Appearance
- purple solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
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 statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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