4-(Dimethylamino)-3,5-dimethylphenol
Basic information
- CAS
6120-10-1- Standard SMILES
Cc1cc(O)cc(C)c1N(C)C- InChIKey
GZPBVLUEICLBOA-UHFFFAOYSA-N- Molecular formula
- C10H15NO
- Average molar mass
- 165.23 g/mol
- Monoisotopic mass
- 165.1153641
Overview
hydrolysis product of Zectran; structure
Names & identifiers
- Preferred name
- 4-(Dimethylamino)-3,5-dimethylphenol
- IUPAC
- 4-(dimethylamino)-3,5-dimethylphenol
- English name
- 4-Dimethylamino-3,5-xylenol
- Molecular formula
- C10H15NO
- Molecular weight
- 165.23
Names & synonyms
4-Dimethylamino-3,5-xylenol4-(Dimethylamino)-3,5-dimethylphenol6120-10-13,5-XYLENOL, 4-(DIMETHYLAMINO)-VY8990GQTIDTXSID2020503RefChem:98767DTXCID40503228-089-34-(Dimethylamino)-3,5-xylenolPhenol, 4-(dimethylamino)-3,5-dimethyl-Caswell No. 359F
Show more names
DMAX4-Dimethylamino-3,5-dimethylphenol
EINECS 228-089-3EPA Pesticide Chemical Code 205200BRN 2936720UNII-VY8990GQTISCHEMBL8565316AKOS006279614DIMETHYLAMINO-3,5-XYLENOL, 4-4-(Dimethylamino)-3,5-dimethylphenol #
Database identifiers
- CAS
6120-10-1- PubChem CID
- 22499
- DTXSID
DTXSID2020503- UNII
- VY8990GQTI
- EC Number
- 228-089-3
- Nikkaji
- J8.345C
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- Melting point
- 88 · 88-92 °C
- Boiling point
- 293.09 °C · 293.09°C (rough estimate)
- Density
- 1.0203 · 1.0203 (rough estimate)
- refractive index
- 1.52 · 1.5200 (estimate)
- pka
- 10.4 · 10.40±0.23(Predicted)
- FDA UNII
- 8990 GQTI · VY8990GQTI
- EPA Substance Registry System
- 4 · 4-(Dimethylamino)-3,5-xylenol (6120-10-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- 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 50% (1 of 2) of reports.
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 4-(dimethylamino)-3,5-dimethyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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