Propylparaben (CAS 94-13-3) — formula C10H12O3, molecular weight 180.08 g/mol.
| CAS Number | 94-13-3 |
|---|---|
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.08 g/mol |
| Melting Point | 203 to 208 °F (NTP, 1992) |
| Boiling Point | 271 °F at 1 mmHg (NTP, 1992) |
| LogP | 3 |
| Applications | Laboratory chemicals, Preservative |
Documented applications: Laboratory chemicals, Preservative.
Propylparaben is a chemical compound with CAS registry number 94-13-3 and molecular formula C10H12O3 (molecular weight 180.08 g/mol).
CAS number: 94-13-3
Its molecular formula C10H12O3 comprises 10 C, 12 H, 3 O atoms.
Also known as: Propylparaben · 尼泊金丙酯
The CAS registry number of Propylparaben is 94-13-3.
Molecular formula C10H12O3, molecular weight 180.08 g/mol.
It is also registered under: Propylparaben, 尼泊金丙酯.
Recorded applications: Laboratory chemicals, Preservative.
Independent reference data for Propylparaben (CAS 94-13-3), compiled from public chemistry databases.
| CAS Registry Number | 94-13-3 |
|---|---|
| PubChem CID | 7175 |
| Molecular formula | C10H12O3 |
| Molecular weight | 180.08 g/mol |
| IUPAC name | propyl 4-hydroxybenzoate |
| InChIKey | QELSKZZBTMNZEB-UHFFFAOYSA-N |
| UNII (FDA) | Z8IX2SC1OH |
| ChEBI ID | CHEBI:32063 |
| FEMA number | 2951 |
| Molecular Weight | 180.20 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 180.078644241 |
| Monoisotopic Mass | 180.078644241 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 13 |
| Boiling Point | 271 °F at 1 mmHg (NTP, 1992) |
|---|---|
| Boiling Point | 294.00 to 295.00 °C. @ 760.00 mm Hg |
| Melting Point | 203 to 208 °F (NTP, 1992) |
| Melting Point | 96.1 °C |
| Melting Point | 96 - 97 °C |
| Solubility | In water, 5.00X10+2 mg/L at 25 °C |
| Solubility | In water, 463 mg/L at 20 °C |
| Solubility | 0.5 mg/mL at 25 °C |
| Density | 1.287 g/cu cm at 20 °C |
| Density | Density: 1.0630 g/cu cm at 102 °C |
PROPYLPARABEN; 94-13-3; Propyl paraben; Nipasol; Propyl p-hydroxybenzoate; Nipazol; Propagin; 4-Hydroxybenzoic acid propyl ester; Propyl parahydroxybenzoate; Tegosept P; Nipagin P; Propyl Butex; Betacide P; Nipasol P; Chemocide pk; Propyl Parasept
| Regulatory & Food Contact | FDA Substance added to food: ANTIMICROBIAL AGENT, FLAVORING AGENT OR ADJUVANT PRESERVATIVE: Food Additives WITHDRAWN (2006) TRS 940-JECFA 67/30 FAS 58-JECFA 67 PROPYL p-OXYBENZOATE |
|---|---|
| GHS notification summary | 22.8% (644 / 2829) |
| GHS notification summary | 22.8% (644 / 2829) |
|---|---|
| Reported hazard statements | H315 (63.6%), H319 (66.7%), H335 (63.4%), H302, H317, H370, H373, H401 |
This chemical does not meet GHS hazard criteria for 22.8% (644 of 2829) of reports.
H315 (63.6%): Causes skin irritation [Warning Skin corrosion/irritation]
Propylparaben is identified by CAS 94-13-3, molecular formula C10H12O3 and molecular weight 180.08 g/mol. UNII Z8IX2SC1OH; ChEBI 32063; InChIKey QELSKZZBTMNZEB-UHFFFAOYSA-N. Boiling Point: 271 °F at 1 mmHg (NTP, 1992); Boiling Point: 294.00 to 295.00 °C. @ 760.00 mm Hg; Melting Point: 203 to 208 °F (NTP, 1992).
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 尼泊金丙酯