Name | 7-Aminocephalosporanic acid |
Synonyms | 7-ACA 7-ACA Impurity Aminocephalosporanic Ceftriaxone Impurity 18 Cefazolin EP Impurity H 7-Aminocephalosporanic acid Cefazolin Sodium EP Impurity H (7-Aminocephalosporanic Acid) 3-(Acetoxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 3-[(acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-7-amino-8-oxo- (6R,7R)-3-(acetyloxymethyl)-7-ammonio-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (6R,7R)-3-[(acetyloxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
CAS | 957-68-6 |
EINECS | 213-485-0 |
InChI | InChI=1/C10H12N2O5S/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16/h6,9H,2-3,11H2,1H3,(H,15,16)/t6-,9-/m1/s1 |
InChIKey | HSHGZXNAXBPPDL-HZGVNTEJSA-N |
Molecular Formula | C10H12N2O5S |
Molar Mass | 272.28 |
Density | 1.4667 (rough estimate) |
Melting Point | >300 °C (lit.) |
Boling Point | 560.6±50.0 °C(Predicted) |
Specific Rotation(α) | 94 º (c=0.5, KH2PO4, PH 7) |
Flash Point | 292.9°C |
Water Solubility | 409.6mg/L(22.99 ºC) |
Solubility | DMSO (Very Slightly, Heated) |
Vapor Presure | 4.87E-14mmHg at 25°C |
Appearance | Crystallization |
Color | Off-white to beige |
Merck | 14,434 |
BRN | 622638 |
pKa | 2.59±0.50(Predicted) |
Storage Condition | 2-8°C |
Stability | Hygroscopic |
Refractive Index | 1.5650 (estimate) |
MDL | MFCD00005177 |
Physical and Chemical Properties | Crystals. |
Use | Used as a pharmaceutical Intermediate |
Risk Codes | R42/43 - May cause sensitization by inhalation and skin contact. R36/37/38 - Irritating to eyes, respiratory system and skin. R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. |
Safety Description | S22 - Do not breathe dust. S36/37 - Wear suitable protective clothing and gloves. S24/25 - Avoid contact with skin and eyes. S36 - Wear suitable protective clothing. S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
WGK Germany | 3 |
HS Code | 29349960 |