| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2008 | 10 | No |
Popular Name: N'-hydroxybenzenecarboximidamide N'-hydroxybenzenecarboximidamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 613-92-3 , 99277-23-3 , [613-92-3]
benzenecarboximidamide, N'-hydroxy-
HYDROXYBENZENECARBOXIMIDAMIDE N-'
N'-Hydroxybenzenecarboximidamide hydrochloride
N'-Hydroxybenzimidamide hydrochloride
N'-Pydroxybenzenecarboximidamide
| 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) | 0.25 | 1.38 | -6.32 | 3 | 3 | 0 | 59 | 136.154 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.25 | 1.12 | -31.48 | 4 | 3 | 1 | 60 | 137.162 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.25 | 1.21 | -29.03 | 4 | 3 | 1 | 60 | 137.162 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 72-76? | Alfa-Aesar |
| Melting_Point | 72-76° | Alfa-Aesar |
| melting_point | 74 - 76 | KeyOrganics |
| Mp [°C] | 75 - 77 | Acros Organics |
| MP | 77 | TCI |
| MP | 77° | Matrix Scientific |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Matrix Scientific |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H319: Causes serious eye irritation; H315: Causes skin irritation; H302: Harmful if swallowed; H312: Harmful in contact with skin; H332: Harmful if inhaled | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P305 + P35 | Acros Organics |
| P phrase | P302 + P352: IF ON SKIN: Wash with plenty of soap and water | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | 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.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.