Cas no 502-47-6 (3,7-dimethyloct-6-enoic acid)
3,7-dimethyloct-6-enoic acid structure
Product Name:3,7-dimethyloct-6-enoic acid
CAS No:502-47-6
MF:C10O2
MW:152.105802536011
MDL:MFCD00002728
CID:82384
PubChem ID:10402
Update Time:2025-04-18
3,7-dimethyloct-6-enoic acid Chemical and Physical Properties
Names and Identifiers
-
- citronellic acid
- 3,7-dimethyloct-6-enoic acid
- 3,7-Dimethyl-6-octenoic Acid
- 3,7-Dimethyl-6-octenoic acid,Citronellic acid
- Rhodinic Acid
-
- MDL： MFCD00002728
- Inchi： 1S/C10O2/c1-8(2)5-4-6-9(3)7-10(11)12
- InChI Key： XSQKASVOZUBTCW-UHFFFAOYSA-N
- SMILES： [C][C]([C]C(=O)[O])[C][C]/[C]=C(\[C])/[C] |^1:0,1,5,8,10,11,^4:2,6,7|
Computed Properties
- Exact Mass: 170.13100
- Monoisotopic Mass: 170.131
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 167
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- XLogP3: 3
- Topological Polar Surface Area: 37.3
Experimental Properties
- Color/Form: Colorless liquid
- Density: 0.923?g/mL?at 25?°C(lit.)
- Melting Point: No data available
- Boiling Point: 121-122?°C/1?mmHg(lit.)
- Flash Point: Degrees Fahrenheit:235.4°F
Degrees Celsius:113°C - Refractive Index: n20/D 1.454(lit.)
- Water Partition Coefficient: Insoluble in water.
- PSA: 37.30000
- LogP: 2.84360
- FEMA: 3142 | 3,7-DIMETHYL-6-OCTENOIC ACID
- Solubility: Not determined
- Vapor Pressure: 0.0±1.1 mmHg at 25°C
3,7-dimethyloct-6-enoic acid Security Information
-
Symbol:
- Prompt：dangerous
- Signal Word：Danger
- Hazard Statement： H311-H315
- Warning Statement： P280-P312
- Hazardous Material transportation number：UN 2810 6.1/PG 3
- WGK Germany：3
- Hazard Category Code： 21-38
- Safety Instruction： S36/37
- RTECS：RH3230000
-
Hazardous Material Identification：
- HazardClass：6.1
- PackingGroup：III
- TSCA：Yes
- Safety Term：6.1
- Packing Group：III
- Risk Phrases：R21
- Packing Group：III
- Hazard Level：6.1
- Storage Condition：4° CStore…,-4℃Store…Better
3,7-dimethyloct-6-enoic acid Customs Data
- HS CODE：2916190090
- Customs Data：
China Customs Code:
2916190090Overview:
2916190090 Other unsaturated acyclic monocarboxylic acids(Including its anhydride\Acyl halide,Peroxides and peroxyacids and their derivatives).Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly
Regulatory conditions:
A.Customs clearance form for Inbound Goods
B.Customs clearance form for outbound goodsInspection and quarantine category:
R.Sanitary supervision and inspection of imported food
S.Sanitary supervision and inspection of exported food
M.Import commodity inspection
N.Export commodity inspectionSummary:
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%
3,7-dimethyloct-6-enoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | C869003-25ml |
Citronellic Acid |
502-47-6 | 95% | 25ml |
￥1,255.00 | 2022-09-02 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | WG639-1ml |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95.0%(T) | 1ml |
￥144.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | WG639-5ml |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95.0%(T) | 5ml |
￥432.0 | 2022-05-30 | |
| abcr | AB132829-25 g |
Citronellic acid, 90%; . |
502-47-6 | 90% | 25 g |
€71.80 | 2023-07-20 | |
| abcr | AB132829-100 g |
Citronellic acid, 90%; . |
502-47-6 | 90% | 100 g |
€135.80 | 2023-07-20 | |
| abcr | AB132829-500 g |
Citronellic acid, 90%; . |
502-47-6 | 90% | 500 g |
€575.00 | 2023-07-20 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | C153558-100g |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95% | 100g |
￥1884.90 | 2023-09-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | C153558-25g |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95% | 25g |
￥788.90 | 2023-09-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | C153558-500g |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95% | 500g |
￥4840.90 | 2023-09-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | C153558-5g |
3,7-dimethyloct-6-enoic acid |
502-47-6 | 95% | 5g |
￥260.90 | 2023-09-03 |
3,7-dimethyloct-6-enoic acid Related Literature
-
Hanna Busch,Florian Stempfle,Sandra He?,Etienne Grau,Stefan Mecking Green Chem. 2014 16 4541
-
Ajay Verma,Sadhan Jana,Ch. Durga Prasad,Abhimanyu Yadav,Sangit Kumar Chem. Commun. 2016 52 4179
-
Subi J. George,?eljko Tomovi?,Albertus P. H. J. Schenning,E. W. Meijer Chem. Commun. 2011 47 3451
-
Cameron C. Lee,Christophe Grenier,E. W. Meijer,Albertus P. H. J. Schenning Chem. Soc. Rev. 2009 38 671
-
Andreas Steffen,Maximilian Karasz,Carolin Thiele,Thomas Lengauer,Andreas K?mper,Gerhard Wenz,Joannis Apostolakis New J. Chem. 2007 31 1941
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