Basic information
- CAS
18675-24-6- Standard SMILES
CCCCCCCCC(C)CO- InChIKey
JZEUFFFBEMAJHS-UHFFFAOYSA-N- Molecular formula
- C11H24O
- Average molar mass
- 172.31 g/mol
- Monoisotopic mass
- 172.18271539
Names & identifiers
- Preferred name
- 1-Decanol, 2-methyl-
- IUPAC
- 2-methyldecan-1-ol
- English name
- 2-Methyl-1-decanol
- Molecular formula
- C11H24O
- Molecular weight
- 172.31
Names & synonyms
2-Methyl-1-decanol18675-24-61-Decanol, 2-methyl-EINECS 242-494-2DTXSID30885064RefChem:75549DTXCID401007605JZEUFFFBEMAJHS-UHFFFAOYSA-N2-Methyldecan-1-olMFCD022586782-methyldecanol(-)-2-methyldecanol
Show more names
1-Decanol, 2-methyl-，98%
2-Methyl-1-decanol #SCHEMBL31047SCHEMBL1021842TAA67524AKOS013993208NS00052591H85516
Database identifiers
- CAS
18675-24-6- PubChem CID
- 86776
- DTXSID
DTXSID30885064- EC Number
- 242-494-2
- Nikkaji
- J222.272H
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 81
Experimental & physicochemical properties
Kovats Retention Index1803
Physicochemical properties
- Melting point
- 11.58 °C · 11.58°C (estimate)
- Boiling point
- 232.66 °C · 232.66°C (estimate)
- Density
- 0.8447 · 0.8447 (estimate)
- refractive index
- 1.4131 · 1.4131 (estimate)
- Flash point
- 93.3 ° · >93.3°
- pka
- 15.04 · 15.04±0.10(Predicted)
- LogP
- 4.41 · 4.410 (est)
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- 1 · 1-Decanol, 2-methyl- (18675-24-6)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P273-P281-P302+P352-P304+P340-P305+P351+P338
- RIDADR
- 3082 · UN3082
- TSCA
- TSCA listed
- HazardClass
- 9 · 9
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
Safety data
- tsca
- TSCA listed
- ridadr
- UN3082
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_class
- 9
- Hazard statements
- H302-H315-H319-H335
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P261-P273-P281-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Decanol, 2-methyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers12 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
北京东华力拓科技发展有限公司010-88425576 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海拉曼达医药科技有限公司021-19921844 19921844785 · [email protected]
成都格里迈特医药技术有限公司17308078590; 15928855497 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
BOC Sciences[email protected]
Novachemistry44-20819178-90 02081917890 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
1 records
Compound notes
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