In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 13 | Yes |
Popular Name: Dicyclohexylamine Dicyclohexylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 101-83-7 , 10421-85-9 , 122-39-4 , 200334-95-8 , 263703-32-8 , 3129-91-7 , 4111-55-1 , N/A , [3129-91-7]
(S)-2-Acetylsulfanyl-4-methyl-pentanoic acid dicyclohexylamine
(S)-2-Acetylsulfanyl-4-methylpentanoic acid dicyclohexylamine salt
101-83-7; C14686; Dicyclohexylamine; N-Cyclohexylcyclohexanamine
Dicyclohexylamine 2-cyanoacrylate
Dicyclohexylammonium (R)-2-(Boc-amino)-4-(tert-butoxy)-4-oxobutyrate
dicyclohexylammonium (S)-5-amino-2-azido-5-oxopentanoate
N-Boc-D-aspartic acid 4-tert-butyl ester dicyclohexylammonium salt, 98%
propanoic acid, 3-ethoxy-2-methyl-, compd. with N-cyclohexylcyclohexanamine (1:1)
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) | 3.91 | 7.05 | -34.05 | 2 | 1 | 1 | 17 | 182.331 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.89 | 12.03 | -51.79 | 3 | 8 | 1 | 92 | 435.552 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 2 | Acros Organics |
Melting_Point | 2? | Alfa-Aesar |
Melting_Point | 2° | Alfa-Aesar |
BP [°C] | 256 | Acros Organics |
Boiling_Point | 256? | Alfa-Aesar |
Boiling_Point | 256° | Alfa-Aesar |
Purity | 95% | Fluorochem |
Hazard | C: Corrosive | Acros Organics |
PUBCHEM_PATENT_ID | EP0548274B1 | IBM Patent Data |
H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage; H410: Very toxic to aquatic life with long lasting effects; H301: Toxic if swallowed; H311: Toxic in contact with skin | Acros Organics |
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 | R22: Harmful if swallowed. | Acros Organics |
R phrase | R24/25: Toxic in contact with skin and if swallowed.; R34: Causes burns.; R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | Acros Organics |
S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
Hazard | T: Toxic; N: Dangerous for the environment | Acros Organics |