Cas no 151-19-9 (3-Octanol,3,6-dimethyl-)
3-Octanol,3,6-dimethyl- structure
Product Name:3-Octanol,3,6-dimethyl-
CAS No:151-19-9
MF:C10H22O
MW:158.281083583832
CID:163162
Update Time:2025-04-19
3-Octanol,3,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Octanol,3,6-dimethyl-
- 3,6-DIMETHYL-3-OCTANOL
- 3,6-dimethyloctan-3-ol
- 3,6-dimethyl-3-hydroxy-octane
- 3,6-Dimethyl-octan-3-ol
- 3,6-dimethyloctane-3-ol
- 3-Octanol,3,6-dimethyl
- 3-Octanol,6-dimethyl
- Aprol 100
- AR 1
- EINECS 205-787-6
- PELARGOL
- FEMA 2391
- DIMETHYLOCTANOL
- TETRAHYDROGERANIOL
- 3,6-Dimethyloctanol
- DIHYDROCITRONENELLOL
- 3,7-DIMETHYL OCTANOL
- ar1
- aprol100
-
- Inchi： 1S/C10H22O/c1-5-9(3)7-8-10(4,11)6-2/h9,11H,5-8H2,1-4H3
- InChI Key： NPHCXUPGMINOPP-UHFFFAOYSA-N
- SMILES： C(O)(C)(CC)CCC(C)CC
Computed Properties
- Exact Mass: 158.16700
- Monoisotopic Mass: 158.167
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 101
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.3
- Topological Polar Surface Area: 20.2A^2
Experimental Properties
- Color/Form: Colorless transparent liquid
- Density: 0.828?g/mL?at 20?°C(lit.)
- Melting Point: -67.5°C
- Boiling Point: 98-99?°C9?mm Hg(lit.)
- Flash Point: 203?°F
- Refractive Index: n20/D 1.436(lit.)
- PSA: 20.23000
- LogP: 2.97370
- Vapor Pressure: <0.01 mm Hg ( 20 °C)
3-Octanol,3,6-dimethyl- Security Information
- WGK Germany：1
- Hazard Category Code： 36/37/38
- Safety Instruction： S23; S26; S36
- RTECS：RH0900000
-
Hazardous Material Identification：
- Risk Phrases：R36/37/38
3-Octanol,3,6-dimethyl- Customs Data
- HS CODE：2905199090
- Customs Data：
China Customs Code:
2905199090Overview:
2905199090. Other saturated monohydric alcohols. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, packing
Summary:
2905199090. saturated monohydric alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%
3-Octanol,3,6-dimethyl- Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
151-19-9 (3-Octanol,3,6-dimethyl-) Related Products
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