Introduction：Basic information about CAS 502-47-6|CITRONELLIC ACID, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | CITRONELLIC ACID |
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| CAS Number | 502-47-6 | Molecular Weight | 170.24900 |
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| Density | 0.923 g/mL at 25 °C(lit.) | Boiling Point | 121-122 °C1 mm Hg(lit.) |
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| Molecular Formula | C10H18O2 | Melting Point | / |
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| MSDS | ChineseUSA | Flash Point | >230 °F |
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| Symbol |
GHS06 | Signal Word | Danger |
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Names
| Name | Citronellic Acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.923 g/mL at 25 °C(lit.) |
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| Boiling Point | 121-122 °C1 mm Hg(lit.) |
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| Molecular Formula | C10H18O2 |
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| Molecular Weight | 170.24900 |
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| Flash Point | >230 °F |
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| Exact Mass | 170.13100 |
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| PSA | 37.30000 |
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| LogP | 2.84360 |
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| Index of Refraction | n20/D 1.454(lit.) |
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| InChIKey | GJWSUKYXUMVMGX-UHFFFAOYSA-N |
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| SMILES | CC(C)=CCCC(C)CC(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- RH3230000
- CHEMICAL NAME :
- 6-Octenoic acid, 3,7-dimethyl-
- CAS REGISTRY NUMBER :
- 502-47-6
- BEILSTEIN REFERENCE NO. :
- 1722960
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C10-H18-O2
- MOLECULAR WEIGHT :
- 170.28
- WISWESSER LINE NOTATION :
- QV1Y1&3UY1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,653,1982 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 2610 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,653,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 450 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,653,1982 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X5133 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 1557 (estimated) No. of Female Employees: 276 (estimated)
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Safety Information
| Symbol |
GHS06 |
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| Signal Word | Danger |
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| Hazard Statements | H311-H315 |
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| Precautionary Statements | P280-P312 |
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| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | R21 |
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| Safety Phrases | S36/37 |
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| RIDADR | UN 2810 6.1/PG 3 |
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| WGK Germany | 3 |
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| RTECS | RH3230000 |
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| Packaging Group | III |
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| Hazard Class | 6.1 |
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| HS Code | 2916190090 |
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Customs
| HS Code | 2916190090 |
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| Summary | 2916190090 unsaturated acyclic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0% |
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Articles3
More Articles
| Isolation and characterization of Pseudomonas aeruginosa mutants deficient in the utilization of the terpenoid citronellic acid. World J. Microbiol. Biotechnol. 9(5) , 562-5, (1993) Eighteen non-sibling mutants of Pseudomonas aeruginosa PAO were isolated that were deficient in the utilization of the β-methyl branched acid citronellic acid but not in the utilization of the unbranc... | |
| Citronellic acid: A major component in two Pelargonium species (Geraniaceae). Lis-Balchin M and Roth G. J. Essent. Oil Res. 11(1) , 83-85, (1999)
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| Stereocontrolled synthesis of all of the possible stereoisomers of 3, 11-dimethylnonacosan-2-one and 29-hydroxy-3, 11-dimethylnonacosan-2-one: The female sex pheromone of the german cockroach. Mori K, et al. Tetrahedron 37(7) , 1329-40, (1981)
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Synonyms
| MFCD00002728 |
| 3,7-Dimethyl-6-octenoic acid,Citronellic acid |
| Citronellic acid |
| EINECS 207-939-7 |
| 3,7-Dimethyl-6-octenoic Acid |
| Rhodinic Acid |
| 3,7-dimethyloct-6-enoic acid |
