Phenol, 2-propyl
Phenol, 2-propyl structure
|
Common Name | Phenol, 2-propyl | ||
|---|---|---|---|---|
| CAS Number | 644-35-9 | Molecular Weight | 136.19100 | |
| Density | 0.989 g/mL at 25 °C(lit.) | Boiling Point | 224-226 °C(lit.) | |
| Molecular Formula | C9H12O | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 200 °F | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: 2-Propylphenol (Phenol, 2-propyl-, CAS号：644-35-9), molecular formula C9H12O, molecular weight 136.19100. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-n-propylphenol |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.989 g/mL at 25 °C(lit.) |
|---|---|
| Boiling Point | 224-226 °C(lit.) |
| Molecular Formula | C9H12O |
| Molecular Weight | 136.19100 |
| Flash Point | 200 °F |
| Exact Mass | 136.08900 |
| PSA | 20.23000 |
| LogP | 2.34470 |
| Index of Refraction | n20/D 1.527(lit.) |
| InChIKey | LCHYEKKJCUJAKN-UHFFFAOYSA-N |
| SMILES | CCCc1ccccc1O |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H312-H315-H319-H332-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R22;R36/37/38 |
| Safety Phrases | S26-S28-S36/37/39-S45 |
| RIDADR | UN 3145 8/PG 3 |
| WGK Germany | 3 |
| RTECS | SM8600000 |
| Packaging Group | III |
| Hazard Class | 8 |
| HS Code | 29071900 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
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CAS#:83816-53-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2907199090 |
|---|---|
| Summary | 2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Cellular apoptosis and cytotoxicity of phenolic compounds: a quantitative structure-activity relationship study.
J. Med. Chem. 48 , 7234-42, (2005) In this comprehensive study on the caspase-mediated apoptosis-inducing effect of 51 substituted phenols in a murine leukemia cell line (L1210), we determined the concentrations needed to induce caspas... |
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Selection of Pseudomonas sp. strain HBP1 Prp for metabolism of 2-propylphenol and elucidation of the degradative pathway.
Appl. Environ. Microbiol. 59(3) , 860-6, (1993) A mutant of Pseudomonas sp. strain HBP1, originally isolated on 2-hydroxybiphenyl, was selected for the ability to grow on 2-propylphenol as the sole carbon and energy source. In the mutant strain, wh... |
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HbpR, a new member of the XylR/DmpR subclass within the NtrC family of bacterial transcriptional activators, regulates expression of 2-hydroxybiphenyl metabolism in Pseudomonas azelaica HBP1.
J. Bacteriol. 182(2) , 405-17, (2000) The regulation of 2-hydroxybiphenyl and 2,2'-dihydroxybiphenyl degradation in Pseudomonas azelaica is mediated by the regulatory gene, hbpR. The hbpR gene encodes a 63-kDa protein belonging to the Ntr... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| FEMA 3522 |
| 2-PROPYLPHENOL |
| 2(n-propyl)phenol |
| ortho-propylphenol |
| o-propyl-pheno |
| Phenol,o-propyl |
| O-N-PROPYLPHENOL |
| EINECS 211-415-3 |
| o-propyl-phen |
| MFCD00002251 |
| 2-propyl-pheno |
| n-propylphenol |
| Phenol,2-propyl |
| propylphenol |
| o-Propylphenol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 2-n-propylphenol? |
| A: CAS number of 2-n-propylphenol is 644-35-9. |
| Q: What is the molecular formula of 2-n-propylphenol? |
| A: Molecular formula of 2-n-propylphenol is C9H12O. |
| Q: What is the SMILES notation of 2-n-propylphenol? |
| A: SMILES notation of 2-n-propylphenol is CCCc1ccccc1O. |
| Q: What are the downstream products of 2-n-propylphenol? |
| A: Related downstream products(CAS) of 2-n-propylphenol: 22496-46-4;645-56-7;6626-32-0;23167-99-9;108-95-2;1678-92-8;10488-25-2;69-72-7;13629-73-7;83816-53-9. |
| Q: What is the InChIKey of 2-n-propylphenol? |
| A: InChIKey of 2-n-propylphenol is LCHYEKKJCUJAKN-UHFFFAOYSA-N. |
| Q: What English synonyms does 2-n-propylphenol have? |
| A: English synonyms of 2-n-propylphenol: FEMA 3522, 2-PROPYLPHENOL, 2(n-propyl)phenol, ortho-propylphenol, o-propyl-pheno, Phenol,o-propyl, O-N-PROPYLPHENOL, EINECS 211-415-3, o-propyl-phen, MFCD00002251, 2-propyl-pheno, n-propylphenol, Phenol,2-propyl, propylphenol, o-Propylphenol. |
| Q: What is the safety information for 2-n-propylphenol? |
| A: Safety information for 2-n-propylphenol: S26-S28-S36/37/39-S45. |
| Q: What is the English name of 2-n-propylphenol? |
| A: The English name of 2-n-propylphenol is 2-n-propylphenol. |
| Q: What is the LogP of 2-n-propylphenol? |
| A: LogP of 2-n-propylphenol is 2.34470. |
| Q: What is the polar surface area (PSA) of 2-n-propylphenol? |
| A: Polar surface area (PSA) of 2-n-propylphenol is 20.23000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |