Basic information
- CAS
118292-37-8- Standard SMILES
COC(=O)c1cc2cc(OC)c(OC)c(OC)c2[nH]1- InChIKey
ZSXHVDGSRITZMF-UHFFFAOYSA-N- Molecular formula
- C13H15NO5
- Average molar mass
- 265.26 g/mol
- Monoisotopic mass
- 265.09502258
Names & identifiers
- Preferred name
- methyl 5,6,7-trimethoxy-1H-indole-2-carboxylate
- IUPAC
- methyl 5,6,7-trimethoxy-1H-indole-2-carboxylate
- English name
- Methyl 5,6,7-trimethoxy-1H-indole-2-carboxylate
- Molecular formula
- C13H15NO5
- Molecular weight
- 265.26
Names & synonyms
methyl 5,6,7-trimethoxy-1H-indole-2-carboxylate118292-37-8DTXSID70403448RefChem:355866DTXCID90354302MFCD04122690methyl 5,6,7-trimethoxyindole-2-carboxylate1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-, methyl esterSCHEMBL29082385,6,7-Trimethoxy-1H-indole-2-carboxylic acid methyl esterZSXHVDGSRITZMF-UHFFFAOYSA-NALBB-037047
Show more names
AKOS JY2083248SALOR-INT L308501-1EA
SBB013583STK784030AKOS000123966ST084618SY369982CS-0287649methyl5,6,7-trimethoxy-1H-indole-2-carboxylateZ363993028
Database identifiers
- CAS
118292-37-8- PubChem CID
- 4453649
- DTXSID
DTXSID70403448- EC Number
- 131-663-5
- Nikkaji
- J1.998.104E
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 69.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 324
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Chemistry & industry
Suppliers5 total
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
常州瑞清医药科技有限公司0519-85859396 15380475813;15380475813 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
5 records
Compound notes
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