Basic information
- CAS
24305-56-4- Standard SMILES
CCCCCCCCCCCCc1ccc(O)cc1O- InChIKey
JJWVPHWHEGQZOE-UHFFFAOYSA-N- Molecular formula
- C18H30O2
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.2245802
Names & identifiers
- Preferred name
- 4-Dodecylresorcinol
- IUPAC
- 4-dodecylbenzene-1,3-diol
- English name
- 4-N-DODECYLRESORCINOL
- Molecular formula
- C18H30O2
- Molecular weight
- 278.43
Names & synonyms
4-Dodecylresorcinol24305-56-4EINECS 246-145-5DTXSID801790414nDodecylresorcinolRefChem:522549DTXCID10101532246-145-54-n-Dodecylresorcinol4-dodecylbenzene-1,3-diol4-n-Laurylresorcinol1,3-Benzenediol, 4-dodecyl-
Show more names
DodecylresorcinolMertansine Impurity 64-n-Dodecylpyresrcinol4-n-Dodecylresorcinol,97%4-N-DODECYLRESORCINOL 98%
MFCD000022824-Dodecyl-1,3-benzenediol4-Laurylresorcinol4-dodecyl resorcinol4-Dodecylresorcinol CRSResorcinol, 4-dodecyl-4-Dodecylresorcinol, 97%3M6LT4SNF7
Database identifiers
- CAS
24305-56-4- PubChem CID
- 90458
- DTXSID
DTXSID80179041- UNII
- 3M6LT4SNF7
- EC Number
- 246-145-5
- Nikkaji
- J149.900I
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 217
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Phenols
LogP5.32
Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionOff-white powder; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- 79 · 79-81 °C (lit.)
- Boiling point
- 224 · 224-226 °C/6 mmHg (lit.)
- Density
- 1.0192 · 1.0192 (rough estimate)
- refractive index
- 1.48 · 1.4800 (estimate)
- storage temp.
- Refrigerator
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Pale Yellow
- InChI
- 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13-14-17(19)15-18(16)20/h13-15,19-20H,2-12H2,1H3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazards SummaryA skin and eye irritant; [Acros Organics MSDS] See Resorcinol.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses4-Dodecylresorcinol is a useful reactant in organic synthesis.
Suppliers12 total
南京迪恩赛尔生物科技有限公司19951952469 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
Related reactions
2 records
Compound notes
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