In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 13 | No |
Popular Name: 3-chlorobenzo[b]thiophene-2-carbonyl chloride 3-chlorobenzo[b]thiophene-2-carb…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 21815-91-8 , [21815-91-8]
"3-Chlorobenzo[b]thiophene-2-carbonyl chloride, 97%"
3-chloro-1-benzothiophene-2-carbonyl chloride
3-Chlorobenzothiophene-2-carbonyl chloride
3-Chlorobenzo[b]-2-thiophenecarboxylic acid chloride
3-Chlorobenzo[b]thiophene-2-carbonyl chloride, 95%
3-CHLOROBENZO[B]THIOPHENE-2-CARBONYLCHLORIDE
benzo[b]thiophene-2-carbonyl chloride, 3-chloro-
Benzo[b]thiophene-2-carbonylchloride, 3-chloro-
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) | 4.20 | 0.14 | -5.75 | 0 | 1 | 0 | 17 | 231.103 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 111 - 113 | Enamine Building Blocks |
Melting_Point | 111-114? | Alfa-Aesar |
Melting_Point | 111-114° | Alfa-Aesar |
MP | 111...113 | Enamine Building Blocks |
Mp [°C] | 113 - 114 | Acros Organics |
MP | 113-117° | Oakwood Chemical |
MP | 114-116° | Fluorochem |
MP | 115 | TCI |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 99% | Fluorochem |
Hazard | C: Corrosive | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
Warnings | IRRITANT | Matrix Scientific |
P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
R phrase | R34: Causes burns. | Acros Organics |
S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
S phrase | 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.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |