ChemicalBook--->CAS DataBase List--->1300-94-3

1300-94-3

1300-94-3 Structure

1300-94-3 Structure
IdentificationBack Directory
[Name]

5-METHYL-2-N-PENTYLPHENOL
[CAS]

1300-94-3
[Synonyms]

Amyleine
AMYL-M-CRESOL
6-AMYL-M-CRESOL
PENTYL-M-CRESOL
AMYL META CRESOL
6-pentyl-m-creso
6-PENTYL-M-CRESOL
6-n-amyl-m-cresol
AMYL(6-)-M-CRESOL
Amylmetacresol CRS
AMYL META CRESOL BP
6-n-pentyl-m-cresol
6-Amyl-m-methylphenol
2-amyl-5-methyl-phenol
5-methyl-2-pentyl-pheno
5-methyl-2-pentylphenol
5-METHYL-2-N-PENTYLPHENOL
Phenol,5-Methyl-2-pentyl-
5-Methyl-2-(pent-1-yl)phenol
5-Methyl-2-(pent-1-yl)phenol 97%
Amylmetacresol for peak identification
Amylmetacresol for peak identification CRS
[EINECS(EC#)]

215-094-0
[Molecular Formula]

C12H18O
[MDL Number]

MFCD00127710
[MOL File]

1300-94-3.mol
[Molecular Weight]

178.27
Chemical PropertiesBack Directory
[Appearance]

Clear or almost clear liquid, or solid crystalline mass, colourless or slightly yellow when freshly prepared. The substance changes colour during storage by darkening and/or discolouration to dark yellow, brownish-yellow or pink.
[Melting point ]

24°C
[Boiling point ]

139°C/15mmHg(lit.)
[density ]

0.9414 (estimate)
[refractive index ]

1.5120 to 1.5160
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Practically insoluble in water, very soluble in acetone and in ethanol (96 per cent).
[form ]

neat
[pka]

10.55±0.35(Predicted)
[color ]

Yellow to Dark Orange
[Major Application]

pharmaceutical (small molecule)
[InChI]

InChI=1S/C12H18O/c1-3-4-5-6-11-8-7-10(2)9-12(11)13/h7-9,13H,3-6H2,1-2H3
[InChIKey]

CKGWFZQGEQJZIL-UHFFFAOYSA-N
[SMILES]

C1(O)=CC(C)=CC=C1CCCCC
[Uses]

Antiseptic.
[EPA Substance Registry System]

Phenol, 5-methyl-2-pentyl- (1300-94-3)
Hazard InformationBack Directory
[Chemical Properties]

Clear or almost clear liquid, or solid crystalline mass, colourless or slightly yellow when freshly prepared. The substance changes colour during storage by darkening and/or discolouration to dark yellow, brownish-yellow or pink.
[Definition]

ChEBI: A phenol having the structure of m-cresol substituted at the 6-position with an amyl group.
[Mode of action]

The mechanism of virucidal action is not fully elucidated, however it is suggested that denaturation of external protein spikes, a pH-induced rearrangement of the tertiary structure of attachment proteins, or a selective effect on viral lipid membranes/protein–lipid interaction is responsible for this action. Amylmetacresol is an antibacterial and antiviral agent, and blocks voltage-gated Na channels in a local anesthetic-like manner.
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P301+P312+P330
[Hazard Codes ]

Xn
[Risk Statements ]

22
[RIDADR ]

UN 3145 8/PG III
[WGK Germany ]

WGK 3
[RTECS ]

GP3100000
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

2907199090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

Amylmetacresol(1300-94-3)1HNMR
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