citronellic acid，CAS 登记号 502-47-6，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于Organic Chemicals。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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3,7-Dimethyl-6-octenoic acid is identified by CAS 502-47-6, molecular formula C10H18O2 and molecular weight 170.13 g/mol. UNII 1JJT408R87; ChEBI 80507; InChIKey GJWSUKYXUMVMGX-UHFFFAOYSA-N. Boiling Point: 121.00 to 122.00 °C. @ 1.00 mm Hg; Boiling Point: 121-122 °C (1 mm Hg); Melting Point: 257 °C.
| CAS Registry Number | 502-47-6 |
|---|---|
| PubChem CID | 10402 |
| Molecular formula | C10H18O2 |
| Molecular weight | 170.13 g/mol |
| IUPAC name | 3,7-dimethyloct-6-enoic acid |
| InChIKey | GJWSUKYXUMVMGX-UHFFFAOYSA-N |
| UNII (FDA) | 1JJT408R87 |
| ChEBI ID | CHEBI:80507 |
| FEMA number | 3142 |
| JECFA number | 1221 |
| Molecular Weight | 170.25 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 170.130679813 |
| Monoisotopic Mass | 170.130679813 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Boiling Point | 121.00 to 122.00 °C. @ 1.00 mm Hg |
|---|---|
| Boiling Point | 121-122 °C (1 mm Hg) |
| Melting Point | 257 °C |
| Density | 0.920-0.926 (20 °C) |
| Refractive Index | 1.455-1.462 |
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H311 |
|---|
H311 (> 99.9%): Toxic in contact with skin [Danger Acute toxicity, dermal]
P262, P264, P270, P280, P302+P352, P316, P321, P361+P364, P405, and P501 (click each P-code to see the statement)
Citronellic acid; 3,7-dimethyloct-6-enoic acid; 502-47-6; 3,7-Dimethyl-6-octenoic acid; Rhodinolic acid; Rhodinic Acid; 6-OCTENOIC ACID, 3,7-DIMETHYL-; FEMA No. 3142; DTXSID1047106; 1JJT408R87; DTXCID9027106; CHEBI:80507; RefChem:577476; 207-939-7; Citronellate; 57030-77-0
CAS 502-47-6; molecular formula C10H18O2; molecular weight 170.13 g/mol.
Citronellic acid, 3,7-dimethyloct-6-enoic acid, 502-47-6, 3,7-Dimethyl-6-octenoic acid, Rhodinolic acid, Rhodinic Acid.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
Hazard statements reported: H311.
Boiling Point: 121.00 to 122.00 °C. @ 1.00 mm Hg; Boiling Point: 121-122 °C (1 mm Hg); Melting Point: 257 °C; Density: 0.920-0.926 (20 °C).
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.