ChemicalBook--->CAS DataBase List--->99-89-8

99-89-8

99-89-8 Structure

99-89-8 Structure
IdentificationMore
[Name]

4-Isopropylphenol
[CAS]

99-89-8
[Synonyms]

4'-HYDROXYCUMENE
4-HYDROXYCUMENE
4-HYDROXYCUMOL
4-ISOPROPYLPHENOL
PARA-ISOPROPYLPHENOL
P-CUMENOL
p-Hydroxycumene
p-lsopropylphenol
1-Hydroxy-4-isopropylbenzene
4-(1-methylethyl)-pheno
4-(1-Methylethyl)phenol
4-(1-methylethyl)-Phenol
Australol
Phenol, p-isopropyl-
phenol,4-(1-methylethyl)-
Phenol,p-isopropyl-
p-isopropyl-pheno
p-Isopropylphenol
Prodox 133
prodox133
[EINECS(EC#)]

202-798-8
[Molecular Formula]

C9H12O
[MDL Number]

MFCD00002372
[Molecular Weight]

136.19
[MOL File]

99-89-8.mol
Chemical PropertiesBack Directory
[Appearance]

WHITE TO BEIGE CRYSTALLINE SOLID
[Melting point ]

59-61 °C (lit.)
[Boiling point ]

212-213 °C (lit.)
[density ]

0.9900
[vapor density ]

>1 (vs air)
[refractive index ]

1.5228
[Fp ]

108°C
[storage temp. ]

Store at +2°C to +8°C.
[solubility ]

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

Crystalline Mass or Crystals
[pka]

10.19±0.13(Predicted)
[color ]

White to beige-brown
[Odor]

at 1.00 % in dipropylene glycol. woody warm spicy medicinal
[Odor Type]

woody
[Water Solubility ]

Slightly soluble in water, soluble in ethanol and ethyl ether.
[BRN ]

1363564
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3
[InChIKey]

YQUQWHNMBPIWGK-UHFFFAOYSA-N
[SMILES]

CC(C)c1ccc(O)cc1
[LogP]

2.900
[CAS DataBase Reference]

99-89-8(CAS DataBase Reference)
[NIST Chemistry Reference]

Phenol, 4-(1-methylethyl)-(99-89-8)
[EPA Substance Registry System]

99-89-8(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
[Signal word ]

Danger
[Hazard statements ]

H302+H312+H332-H314
[Precautionary statements ]

P260-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
[Hazard Codes ]

C
[Risk Statements ]

R22:Harmful if swallowed.
R34:Causes burns.
R43:May cause sensitization by skin contact.
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2430 8/PG 3
[WGK Germany ]

2
[RTECS ]

SL5950000
[Hazard Note ]

Corrosive/Harmful
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29071900
[Storage Class]

8B - Non-combustible corrosive hazardous materials
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

p-Cumenol(99-89-8).msds
Hazard InformationBack Directory
[Chemical Properties]

WHITE TO BEIGE CRYSTALLINE SOLID
[Uses]

4-Isopropylphenol is an Impurity of Propofol (P829750).
[Uses]

4-Isopropylphenol was used in the synthesis of vinyl compounds. It is used as a flavor & fragrance agent in cosmetics.
[Definition]

ChEBI: 4-isopropylphenol is a member of the class of phenols that is phenol which is carrying an isopropyl group at position 4. It has a role as a flavouring agent. It derives from a hydride of a cumene.
[Production Methods]

4-Isopropylphenol is produced:
1) by isolation from Eucalyptus polybractea oil.
2) from Magnesium para-iso-propylphenyl-bromide by air oxidation.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 71, p. 3889, 1949 DOI: 10.1021/ja01180a005
Synthesis, p. 396, 1978 DOI: 10.1055/s-1978-24762
[General Description]

Sonochemical degradation of 4-Isopropylphenol has been studied.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Isopropylphenol(99-89-8)MS
4-Isopropylphenol(99-89-8)1HNMR
4-Isopropylphenol(99-89-8)13CNMR
4-Isopropylphenol(99-89-8)IR1
4-Isopropylphenol(99-89-8)IR2
4-Isopropylphenol(99-89-8)IR3
4-Isopropylphenol(99-89-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Isopropylphenol, 98%(99-89-8)
[Alfa Aesar]

4-Isopropylphenol, 98%(99-89-8)
[Sigma Aldrich]

99-89-8(sigmaaldrich)
[TCI AMERICA]

4-Isopropylphenol,>99.0%(GC)(99-89-8)
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