Basic information
- CAS
364615-65-6- Standard SMILES
CCc1nc2sc(C(=O)OC)c(N)c2c2c1CCCC2- InChIKey
IDKXWTFMQLZAJB-UHFFFAOYSA-N- Molecular formula
- C15H18N2O2S
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.10889899
Names & identifiers
- Preferred name
- Methyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
- IUPAC
- methyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
- English name
- methyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
- Molecular formula
- C15H18N2O2S
- Molecular weight
- 290.38
Names & synonyms
364615-65-6methyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylateMETHYL 1-AMINO-5-ETHYL-6H,7H,8H,9H-THIENO[2,3-C]ISOQUINOLINE-2-CARBOXYLATEMETHYL 1-AMINO-5-ETHYL-6,7,8,9-TETRAHYDROTHIENO(2,3-C)ISOQUINOLINE-2-CARBOXYLATESTK055256AKOS002914595ST51016495VU0494527-1SR-01000909098SR-01000909098-1F1798-0502methyl 1-amino-5-ethyl-6,7,8,9-tetrahydrothiopheno[2,3-c]isoquinoline-2-carbox ylate
Show more names
Thieno[2,3-c]isoquinoline-2-carboxylic acid, 1-amino-5-ethyl-6,7,8,9-tetrahydro-, methyl ester
Database identifiers
- CAS
364615-65-6- PubChem CID
- 920367
- EC Number
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 379
Physicochemical properties
- Boiling point
- 448.7 · 448.7±40.0 °C(Predicted)
- Density
- 1.284 · 1.284±0.06 g/cm3(Predicted)
- pka
- 7.1 · 7.10±0.20(Predicted)
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
Suppliers3 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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