| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 17 | Yes |
Popular Name: Procaine hydrochloride Procaine hydrochloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 129083-48-3 , 459-46-1 , 51-05-8 , 51-05-8, 59-46-1 [procain , 51-05-8, 59-46-1 [procaine] , 59-46-1 , [51-05-8] , [59-46-1]
.beta.-(Diethylamino)ethyl p-aminobenzoate
.beta.-Diethylaminoethyl 4-aminobenzoate
1-(Bromomethyl)-4-fluorobenzene
2-(diethylamino)ethyl 4-aminobenzoate
2-(diethylamino)ethyl 4-aminobenzoate dihydrate
2-(Diethylamino)ethyl 4-aminobenzoate hydrochloride
2-(Diethylamino)ethyl p-aminobenzoate
2-(Diethylamino)ethyl-4-aminobenzoate
2-Diethylaminoethyl 4-aminobenzoate
2-Diethylaminoethyl 4-aminobenzoate hydrochloride
2-Diethylaminoethyl 4-aminobenzoate hydrochloride, 99%
2-Diethylaminoethyl p-aminobenzoate
2-Diethylaminoethylester kyseliny p-aminobenzoove
2-Diethylaminoethylester kyseliny p-aminobenzoove [Czech]
4-14-00-01138 (Beilstein Handbook Reference)
4-Amino-benzoic acid 2-diethylamino-ethyl ester
4-amino-benzoic acid 2-diethylammonio-ethyl ester monocation
4-Aminobenzoesaeure-beta-diethylaminoethylester
4-Aminobenzoic acid 2-(diethylamino) ethyl ester
4-Aminobenzoic acid diethylaminoethyl ester
51-05-8; C07894; Procaine hydrochloride
51-05-8; D00740; Novocain (TN); Procaine hydrochloride (JP16/USP)
51-05-8; Prestwick_530; Procaine hydrochloride
59-46-1; D08422; Procaine (INN); Solution of novocain (TN)
benzoic acid, 4-amino-, 2-(diethylamino)ethyl ester
Benzoic acid, p-amino-, 2-(diethylamino)ethyl ester
BENZOIC ACID,4-AMINO,2-DIETHYLAMINOETHYL ESTER PROCAIN BASE
beta-(Diethylamino)ethyl 4-aminobenzoate
beta-(Diethylamino)ethyl p-aminobenzoate
beta-Diethylaminoethyl 4-aminobenzoate
C13H20N2O2.C9H13NO3.Cl; EPINEPHRINE; PROCAINE HYDROCHLORIDE; LS-178632; PROCAINE HCL W/ EPINEPHRINE
CPD000718771; Novocain; SAM002554920
CPD000718771; Procaine hydrochloride; SAM002554920
Diethylaminoethyl P-Aminobenzoate
InChI=1/C13H20N2O2/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H
Novocaine;Procaine hydrochloride
p-Aminobenzoic acid 2-diethylaminoethyl ester
P-Aminobenzoyldiethylaminoethanol
p-Aminobenzyoyldiethylaminoethanol
Procaine Hydrochloride [51-05-8]; (Novocaine hydrochloride)
PROCAINE HYDROCHLORIDE, [3,5-3H]
PROCAINE HYDROCHLORIDE; [51-05-8]
| 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) | 1.97 | 6.7 | -35.87 | 3 | 4 | 1 | 57 | 237.323 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.60 | 5.48 | -104.65 | 4 | 9 | 2 | 81 | 456.538 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 2.05 | Bitter DB |
| Mp [°C] | 154 - 158 | Acros Organics |
| MP | 155 - 156 | Enamine Building Blocks |
| MP | 155-156 °C(lit.) | Indofine |
| Melting_Point | 155-157? | Alfa-Aesar |
| Melting_Point | 155-157° | Alfa-Aesar |
| MP | 155...156 | Enamine Building Blocks |
| MP | 156 | TCI |
| Boiling_Point | 195-196?/17mm | Alfa-Aesar |
| Boiling_Point | 195-196°/17mm | Alfa-Aesar |
| ALOGPS_SOLUBILITY | 6.81e+00 g/l | DrugBank-approved |
| MP | 62° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Therapy | anesthetic (local) | SMDC Iconix |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H301: Toxic if swallowed; H315: Causes skin irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : P-2012; NCC_SUPPLIER_SAMPLE_COMMENTS : WHITE CRYSTALS; 1 hydrogen chloride | NIH Clinical Collection via PubChem |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protec | Acros Organics |
| R phrase | R25: Toxic if swallowed. | Acros Organics |
| R phrase | R25: Toxic 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.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label wher | Acros Organics |
| PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: P-2012; SALT: 1 hydrogen chloride; SUPPLIER_COMMENTS: WHITE CRYSTALS | NIH Clinical Collection via PubChem |
| Target | Sodium Channel | Selleck Chemicals |
| Hazard | T: Toxic | Acros Organics |
