| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | No |
Popular Name: ethyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate ethyl 2-amino-4,5,6,7-tetrahydro…
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CAS Numbers: 108354-78-5 , 4506-71-2 , 4506-71-2; 108354-78-5 , [108354-78-5] , [4506-71-2]
"2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester, 98%"
2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-
2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester
2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid ethyl ester
benzo[b]thiophene-3-carboxylic acid, 2-amino-4,5,6,7-tetrahydro-, ethyl ester
Ethyl 2-amino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 98%
Ethyl 2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 99%
ethyl-2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.52 | 5.64 | -7.76 | 2 | 3 | 0 | 52 | 225.313 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 113 - 115 | Enamine Building Blocks |
| Mp [°C] | 113 - 117 | Acros Organics |
| MP | 113...115 | Enamine Building Blocks |
| melting_point | 114 - 116 | KeyOrganics |
| Melting_Point | 114-116? | Alfa-Aesar |
| MP | 114-116° | Oakwood Chemical |
| MP | 115 | TCI |
| mp | 115 - 116 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 115-117° | Oakwood Chemical |
| MP | 115-117°C | Fluorochem |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
