| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 4 | Yes |
Popular Name: n-Propyl alcohol n-Propyl alcohol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 102910-31-6 , 23519-77-9 , 38874-17-8 , 4712-36-1 , 71-23-8
1-Propanol, 99.5%, Extra Dry, AcroSeal®
1-Propanol, 99.5%, for analysis
1-Propanol, anhydrous, 99.9%, packaged under Argon in resealable ChemSeal^t bottles
1-Propanol, for spectroscopy ACS
1-Propanol, HPLC Grade, 99% min
1-Propanol, specified according to the requirements of Ph.Eur.
1-Propanol, Spectrophotometric Grade
1-Propanol, Spectrophotometric Grade, 99%
CHEBI:44960; CHEBI:8472; CHEBI:26278
ethyl carbinol; n-Propylalkohol; n-propan-1-ol; propanol-1
Niobium n-propoxide, 99% (metals basis)
| 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) | 0.56 | -1.43 | -2.49 | 1 | 1 | 0 | 20 | 60.096 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 127 | Acros Organics |
| Melting_Point | 127? | Alfa-Aesar |
| Melting_Point | 127° | Alfa-Aesar |
| Boiling_Point | 166?/0.05mm | Alfa-Aesar |
| Boiling_Point | 166°/0.05mm | Alfa-Aesar |
| ALOGPS_SOLUBILITY | 3.91e+02 g/l | DrugBank-experimental |
| BP [°C] | 97 | Acros Organics |
| Boiling_Point | 97? | Alfa-Aesar |
| Boiling_Point | 97° | Alfa-Aesar |
| UniProt Database Links | ADHA_THEET; ADHN_AMYME; ADHN_RHOER; ADHP_ECOLI; ALCS_EMENI; COBC_PSEAE; COBC_PSEDE; COBDQ_LEPIN; COBD_SALTI; COBD_SALTY; COBD_THETN; DHAA_RHOSO; FDM_PSEPU; GRE2_YEAST | ChEBI |
| Patent Database Links | EP0811617; EP0856515; EP0905130; EP0963980; EP0994115; EP1048653; EP1166643; EP1182204; EP1209148; EP1209159; EP1215209; EP1321462; EP1344775; EP1352687; EP1359149; EP1454899; EP1541692; EP1595883; EP1600443; EP1607388; EP1614672; EP1634583; EP1647271; EP | ChEBI |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; XI: Irritant | Acros Organics |
| H phrase | H336: May cause drowsiness or dizziness | Acros Organics |
| H phrase | H336: May cause drowsiness or dizziness; H318: Causes serious eye damage; H225: Highly flammable liquid and vapor | Acros Organics |
| P phrase | P280: Wear eye protection/face protection | Acros Organics |
| P phrase | 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 rinsing; P310: Immediately call a POISON CENTER or doctor/physician; P26 | Acros Organics |
| R phrase | R11: Highly flammable. | Acros Organics |
| R phrase | R11: Highly flammable.; R41: Risk of serious damage to eyes.; R67: Vapours may cause drowsiness and dizziness. | Acros Organics |
| S phrase | S7: Keep container tightly closed. | Acros Organics |
| S phrase | S7: Keep container tightly closed.; S16: Keep away from sources of ignition - No smoking.; S24: Avoid contact with skin.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S39: Wear eye/face protection. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.