| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 14 | Yes |
Popular Name: (1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane (1S,4S)-2-Boc-2,5-diazabicyclo[2…
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CAS Numbers: 113451-59-5 , 1217644-72-8 , 134003-84-2 , 198989-07-0 , [113451-59-5] , [198989-07-0]
(1R,4R)-TERT-BUTYL 2,5-DIAZABICYCLO[2.2.1]HEPTANE-
(1R,4R)-TERT-BUTYL 2,5-DIAZABICYCLO[2.2.1]HEPTANE-2-CARBOXYLATE HYDROCHLORIDE
(1r,4r)-tert-butyl2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
(1R,4R)-TERT-BUTYL2,5-DIAZABICYCLO[2.2.1]HEPTANE-2-CARBOXYLATEHYDROCHLORIDE
(1S,4S)-(-)-2-Boc-2,5-diazabicyclo[2.2.1]heptane
(1S,4S)-(-)-2-BOC-2,5-diazabicyclo[2.2.1]heptane, 95%
(1S,4S)-(-)-2-Boc-2,5-diazabicyclo[2.2.1]heptane, 97%
(1S,4S)-(-)-2-Boc-2,5-diazabicyclo[2.2.1]heptane, 98%
(1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane, 97%
(1S,4S)-N-(tert-Butoxycarbonyl)-2,5-diazabicyclo[2
(1S,4S)-N-(tert-Butoxycarbonyl)-2,5-diazabicyclo[2.2.1]heptane
(1S,4S)-N-Boc-2,5-Diaza-bicyclo[2.2.1]heptane
(1S,4S)-N-Boc-2,5-diazabicyclo[2.2.1]heptane
(1s,4s)-tert-butyl 2,5-diaza-bicyclo[2.2.1]heptane-2-carboxylate
(1S,4S)-tert-Butyl 2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
(1S,4S)-tert-butyl 2,5-diazabicyclo[2.2.1]heptane-2-carboxylate hydrochloride
(1S,4s)-tert-butyl-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate hydrochloride
2-BOC-2,5-DIAZABICYCLO[2.2.1]HEPTANE
2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester
DIAZABICYCLOHEPTANECARBOXYLICACIDBUTYLESTE
N-(tert-Butoxycarbonyl)-2,5-diazabicyclo[2.2.1]heptane
N-Boc-2,5-Diaza-bicyclo[2.2.1]heptane
tert-Butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-carboxylate
tert-Butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
tert-Butyl 2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
tert-Butyl(1S,4S)-(-)-2,5-diazabicyclo[2.2.1]heptane-2-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) | 1.13 | 3.77 | -46.54 | 2 | 4 | 1 | 46 | 199.274 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 11.73 | -41.81 | 2 | 8 | 1 | 76 | 404.498 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 74 - 76 | Acros Organics |
| Melting_Point | 74-76? | Alfa-Aesar |
| Melting_Point | 74-76° | Alfa-Aesar |
| MP | 75-77° | Oakwood Chemical |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H318: Causes serious eye damage | Acros Organics |
| H phrase | H318: Causes serious eye damage; H314: Causes severe skin burns and eye damage | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Irritant/Refrigerate | 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 |
