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21245-02-3

21245-02-3 Structure

21245-02-3 Structure
IdentificationMore
[Name]

2-Ethylhexyl 4-dimethylaminobenzoate
[CAS]

21245-02-3
[Synonyms]

2-ETHYLHEXYL P-(DIMETHYLAMINO)BENZOATE
4-DIMETHYLAMINOBENZOIC ACID 2-ETHYLHEXYL ESTER
ETHYLHEXYL(2-)-4-DIMETHYLAMINOBENZOATE
EUSOLEX(R) 6007
N,N-DIMETHYL-4-AMINOBENZOIC ACID 2-ETHYL-HEXYL ESTER
N,N-DIMETHYLAMINOBENZOIC ACID ISOOCTYL ESTER
OCTYL 4-DIMETHYLAMINOBENZOATE
OCTYL-4-N,N-DIMETHYLAMINOBENZOATE
octyl dimethylaminobenzoate
OCTYL DIMETHYL PABA
OCTYL DIMETHYL-P-AMINO-BENZOATE
OCTYL P-DIMETHYLAMINOBENZOATE
PADIMATE O
P-DIMETHYL-AMINOBENZOIC ACID ISOOCTYL ESTER
SYNCURE EHA
TIMTEC-BB SBB008471
4-(dimethylamino)-benzoicaci2-ethylhexylester
Arlatone UVB
Benzoic acid, 4-(dimethylamino)-, 2-ethylhexyl ester
Benzoicacid,4-(dimethylamino)-,2-ethylhexylester
[EINECS(EC#)]

244-289-3
[Molecular Formula]

C17H27NO2
[MDL Number]

MFCD00017526
[Molecular Weight]

277.4
[MOL File]

21245-02-3.mol
Chemical PropertiesBack Directory
[Melting point ]

242.5-243.5 °C
[Boiling point ]

325 °C (lit.)
[density ]

0.995 g/mL at 25 °C(lit.)
[vapor pressure ]

0.001Pa at 25℃
[refractive index ]

n20/D 1.542(lit.)
[Fp ]

>230 °F
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

neat
[pka]

2.39±0.12(Predicted)
[color ]

Off-White to Orange
[Specific Gravity]

0.995
[Water Solubility ]

100μg/L at 20℃
[Detection Methods]

GC,NMR
[Merck ]

3232
[Henry's Law Constant]

2.5×100 mol/(m3Pa) at 25℃, HSDB (2015)
[Cosmetics Ingredients Functions]

UV ABSORBER
UV FILTER
LIGHT STABILIZER
[InChI]

1S/C17H27NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4/h9-12,14H,5-8,13H2,1-4H3
[InChIKey]

WYWZRNAHINYAEF-UHFFFAOYSA-N
[SMILES]

CCCCC(CC)COC(=O)c1ccc(cc1)N(C)C
[LogP]

6.2
[Uses]

padimate O is the drug name for ethylhexyl dimethyl PABA, a sunscreen chemical formerly known as octyl dimethyl PABA.
[CAS DataBase Reference]

21245-02-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Padimate o(21245-02-3)
[EPA Substance Registry System]

21245-02-3(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)
GHS08
[Signal word ]

Danger
[Hazard statements ]

H360FD
[Precautionary statements ]

P201-P202-P280-P308+P313-P405-P501
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S36:Wear suitable protective clothing .
[WGK Germany ]

2
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29224999
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Repr. 1B
[Hazardous Substances Data]

21245-02-3(Hazardous Substances Data)
Hazard InformationBack Directory
[Chemical Properties]

Colorless to yellow liquid
[Definition]

ChEBI: Padimate O is a benzoate ester.
[General Description]

Padimate O is a tertiary amine derivative of p-aminobenzoic acid (PABA), which is commonly used as a sunscreen agent in cosmetics and other sunscreen formulations due to its ability to absorb ultraviolet radiations.
[Synthesis]

Take p-dimethylaminobenzaldehyde 149g (1mol) dissolved in 600mL of toluene, keep the system temperature at 5 to 10℃, then add 6.5g KH2PO4 and 100mL of water, stirring dropwise addition of NaClO2 (1.35mol, 122.2g) and 1,000mL prepared aqueous s

Spectrum DetailBack Directory
[Spectrum Detail]

2-Ethylhexyl 4-dimethylaminobenzoate(21245-02-3)MS
2-Ethylhexyl 4-dimethylaminobenzoate(21245-02-3)1HNMR
2-Ethylhexyl 4-dimethylaminobenzoate(21245-02-3)13CNMR
2-Ethylhexyl 4-dimethylaminobenzoate(21245-02-3)IR1
2-Ethylhexyl 4-dimethylaminobenzoate(21245-02-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

21245-02-3(sigmaaldrich)
[TCI AMERICA]

2-Ethylhexyl 4-(Dimethylamino)benzoate,>95.0%(T)(21245-02-3)
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