| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 5 | Yes |
Popular Name: (S)-(+)-2-Butanol (S)-(+)-2-Butanol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 14898-79-4 , 15892-23-6 , 2269-22-9 , 4221-99-2 , 78-92-2 , [4221-99-2]
2-Butanol, anhydrous, 99%, packaged under Argon in resealable ChemSeal^t bottles
2-Butanol, anhydrous, 99.9%, packaged under Argon in resealable ChemSeal^t bottles
Aluminium tri-sec-butoxide, 97%
Aluminum sec-butoxide, 95%, packaged under Argon in resealable ChemSeal^t bottles
sec-Butanol, 99%, Extra Dry, AcroSeal®
sec-Butanol, 99+%, Extra Dry, AcroSeal®
| 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) | 0.92 | 0.4 | -2.23 | 1 | 1 | 0 | 20 | 74.123 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 114 | Acros Organics |
| Mp [°C] | 115 | Acros Organics |
| Melting_Point | 115? | Alfa-Aesar |
| Melting_Point | 115° | Alfa-Aesar |
| BP | 100 | TCI |
| BP [°C] | 200 - 206 (p=30 torr) | Acros Organics |
| Boiling_Point | 200-206?/30mm | Alfa-Aesar |
| Boiling_Point | 200-206°/30mm | Alfa-Aesar |
| Purity | 97% | Fluorochem |
| Boiling_Point | 98-101? | Alfa-Aesar |
| Boiling_Point | 98-101° | Alfa-Aesar |
| BP [°C] | 99 | Acros Organics |
| BP [°C] | 99 - 100 | Acros Organics |
| Boiling_Point | 99-100? | Alfa-Aesar |
| Boiling_Point | 99-100° | Alfa-Aesar |
| UniProt Database Links | ADH1_ENTHI; ADHN_AMYME; ADHN_RHOER; ADH_CLOBE; ADH_MYCPN; ADH_THEBR | ChEBI |
| UniProt Database Links | ADH1_ENTHI; ADHN_AMYME; ADH_CLOBE; ADH_MORSE; ADH_MYCPN; ADH_THEBR | ChEBI |
| Hazard | C: Corrosive | Acros Organics |
| Patent Database Links | EP1044969; EP1166643; EP1180516; EP1209148; EP1213280; EP1348689; EP1348692; EP1352687; EP1550725; EP1634880; EP1666476; EP1690858; EP1777217; EP1867640; EP1873152; EP1939170; US2003130539; US2003171597; US2004019211; US2004131648; US2005026940; US2005032 | ChEBI |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage; H312: Harmful in contact with skin; H318: Causes serious eye damage; H226: Flammable liquid and vapor; EUH014: Reacts violently with water | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H336: May cause drowsiness or dizziness; H226: Flammable liquid and vapor; H335: May cause respiratory irritation | Acros Organics |
| H phrase | H336: May cause drowsiness or dizziness | Acros Organics |
| H phrase | H336: May cause drowsiness or dizziness; H319: Causes serious eye irritation; H226: Flammable liquid and vapor | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; 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 | Acros Organics |
| R phrase | R10: Flammable. | Acros Organics |
| R phrase | R10: Flammable.; R14: Reacts violently with water.; R21/22: Harmful in contact with skin and if swallowed.; R34: Causes burns. | Acros Organics |
| R phrase | R10: Flammable.; R36/37: Irritating to eyes and respiratory system.; R67: Vapours may cause drowsiness and dizziness. | Acros Organics |
| S phrase | S7/9: Keep container tightly closed and in a well-ventilated place. | Acros Organics |
| S phrase | S7/9: Keep container tightly closed and in a well-ventilated place.; S13: Keep away from food, drink and animal feedingstuffs.; S24/25: Avoid contact with skin and eyes.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek m | Acros Organics |
| S phrase | S8: Keep container dry. | Acros Organics |
| S phrase | S8: Keep container dry.; S16: Keep away from sources of ignition - No smoking.; 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 protectio | Acros Organics |
| Patent Database Links | US2005054736 | ChEBI |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.