Phenol,4-[(dimethylamino)methyl]-2,6-bis(1-methylethyl)

Modify Date: 2025-08-28 13:52:09

Phenol,4-[(dimethylamino)methyl]-2,6-bis(1-methylethyl) Structure
Phenol,4-[(dimethylamino)methyl]-2,6-bis(1-methylethyl) structure
Common Name Phenol,4-[(dimethylamino)methyl]-2,6-bis(1-methylethyl)
CAS Number 4918-95-0 Molecular Weight 235.36500
Density 0.962g/cm3 Boiling Point 300.6ºC at 760mmHg
Molecular Formula C15H25NO Melting Point 84-86ºC
MSDS N/A Flash Point 104.9ºC

 Names

Name 4-[(dimethylamino)methyl]-2,6-di(propan-2-yl)phenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.962g/cm3
Boiling Point 300.6ºC at 760mmHg
Melting Point 84-86ºC
Molecular Formula C15H25NO
Molecular Weight 235.36500
Flash Point 104.9ºC
Exact Mass 235.19400
PSA 23.47000
LogP 3.70060
Index of Refraction 1.52
InChIKey DEYFSRVIHDNQHT-UHFFFAOYSA-N
SMILES CC(C)c1cc(CN(C)C)cc(C(C)C)c1O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GO8200000
CHEMICAL NAME :
p-Cresol, alpha-(dimethylamino)-2,6-diisopropyl-
CAS REGISTRY NUMBER :
4918-95-0
BEILSTEIN REFERENCE NO. :
2939746
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C15-H25-N-O
MOLECULAR WEIGHT :
235.41
WISWESSER LINE NOTATION :
1Y1&R BQ CY1&1 E1N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - changes in motor activity (specific assay)
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 2,229,1960
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JCSOA9 Journal of the Chemical Society. (London, UK) 1926-65. For publisher information, see JCPRB4. Volume(issue)/page/year: -,191,1947

 Safety Information

Hazard Codes Xi: Irritant;
HS Code 2922299090

 Synthetic Route

~67%

Phenol,4-[(dimethylamino)methyl]-2,6-bis(1-methylethyl) Structure

Phenol,4-[(dime...

CAS#:4918-95-0

Literature: Moehrle, H.; Schake, D. Zeitschrift fuer Naturforschung, B: Chemical Sciences, 1995 , vol. 50, # 12 p. 1859 - 1868

 Precursor & DownStream

Precursor  3

DownStream  0

 Customs

HS Code 2922299090
Summary 2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Bioassay

View more

Name: Partition coefficient (logP)
Source: ChEMBL
Target: N/A
External Id: CHEMBL634673
Name: Antiproliferative activity against Trypanosoma brucei
Source: ChEMBL
Target: Trypanosoma brucei
External Id: CHEMBL897089
Name: Inhibition of [35S]TBPS binding to GABA-A receptor in rat cerebral cortex.
Source: ChEMBL
Target: Gamma-aminobutyric acid receptor subunit alpha-3
External Id: CHEMBL682716
Name: Inhibition of TR by DTNB-coupled assay
Source: ChEMBL
Target: Trypanothione reductase
External Id: CHEMBL897086
Name: Inhibition of human GR
Source: ChEMBL
Target: Glutathione reductase, mitochondrial
External Id: CHEMBL897087
Name: Selectivity for TR over human GR
Source: ChEMBL
Target: N/A
External Id: CHEMBL897088
Total 6, Current Page 1 of 1
1

 Synonyms

2,6-Diisopropyl-4-[(dimethylamino)methyl]phenol
4-Dimethylaminomethyl-2,6-diisopropyl-phenol
2,5-DIHYDRO-3-METHYL-1-PHENYLPHOSPHOLE 1-OXIDE
3-Hydroxybenzyldimethylamine hydrochloride
N.N-Dimethyl-N-(3.5-diisopropyl-4-hydroxybenzyl)amin
(4-hydroxy-3,5-diisopropylbenzyl)-dimethylamine
The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.