Basic information
- CAS
13207-27-7- Standard SMILES
CCCCCCCCCc1cc(C)ccc1O- InChIKey
OILMLWAZYNVPMG-UHFFFAOYSA-N- Molecular formula
- C16H26O
- Average molar mass
- 234.38 g/mol
- Monoisotopic mass
- 234.19836545
Names & identifiers
- Preferred name
- Phenol, 4-methyl-2-nonyl-
- IUPAC
- 4-methyl-2-nonylphenol
- English name
- 2-nonyl-p-cresol
- Molecular formula
- C16H26O
- Molecular weight
- 234.38
Names & synonyms
4-methyl-2-nonylphenolPhenol, 4-methyl-2-nonyl-13207-27-7EINECS 236-175-7DTXSID3065378RefChem:861284DTXCID30340842-Nonyl-p-cresolN7F9US6U37SCHEMBL2822413OILMLWAZYNVPMG-UHFFFAOYSA-NNS00024186
Database identifiers
- CAS
13207-27-7- PubChem CID
- 83233
- DTXSID
DTXSID3065378- UNII
- N7F9US6U37
- EC Number
- 236-175-7
- Nikkaji
- J141.443G
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 178
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 337.5 · 337.5±11.0 °C(Predicted)
- Density
- 0.928 · 0.928±0.06 g/cm3(Predicted)
- pka
- 10.59 · 10.59±0.43(Predicted)
- EPA Substance Registry System
- 4 · Phenol, 4-methyl-2-nonyl- (13207-27-7)
- TSCA
- TSCA listed
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
This chemical does not meet GHS hazard criteria for 100% (37 of 37) of all reports.
Not Classified
Aggregated GHS information provided per 37 reports by companies from 1 notifications to the ECHA C&L Inventory.
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P203, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory InformationChemical: Phenol, 4-methyl-2-nonyl-
Other Safety InformationIMAP assessments - Nonylphenols: Human health tier II assessment
Hazard Classes and Categories
Not Classified
Acute toxicity (ingestion) - category 4
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 4-methyl-2-nonyl-: ACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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