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Basic information
- CAS
19781-43-2- Standard SMILES
CCCCCCCCCCCCC(O)CCC- InChIKey
JIMMILCKVYOFET-UHFFFAOYSA-N- Molecular formula
- C16H34O
- Average molar mass
- 242.44 g/mol
- Monoisotopic mass
- 242.2609657
Names & identifiers
- Preferred name
- 4-Hexadecanol
- IUPAC
- hexadecan-4-ol
- English name
- 4-HEXADECANOL
- Molecular formula
- C16H34O
- Molecular weight
- 242.44
Names & synonyms
4-Hexadecanol19781-43-2DTXSID50275100RefChem:293017DTXCID20226548JIMMILCKVYOFET-UHFFFAOYSA-Nhexadecan-4-ol4-hydroxyhexadecaneSCHEMBL79484SCHEMBL378816SCHEMBL1543206CHEBI:197394
Show more names
hexadecane-4-ol
EINECS 249-583-5MFCD00046691AKOS012718077NS00122530G69827
Database identifiers
- CAS
19781-43-2、29354-98-1- PubChem CID
- 34541
- DTXSID
DTXSID50275100- ChEBI
CHEBI:197394- Nikkaji
- J526.341G
Properties
Computed structural propertiesFilling in
- XLogP
- 7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Melting point
- 38 · 38-39 °C
- Boiling point
- 128 °C · 128 °C(Press: 1 Torr)
- Density
- 0.834 · 0.834±0.06 g/cm3(Predicted)
- pka
- 15.27 · 15.27±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers7 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [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]
上海瀚思化工有限公司18916268197 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
5 records
Compound notes
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