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ChemicalBook--->CAS DataBase List--->83-40-9

83-40-9

83-40-9 Structure

83-40-9 Structure
IdentificationMore
[Name]

3-Methylsalicylic acid
[CAS]

83-40-9
[Synonyms]

2-ANISIC ACID
2-METHOXYBENZOIC ACID
AKOS BBS-00003735
FEMA 3943
O-ANISIC ACID
O-METHOXYBENZOIC ACID
O-METHYLSALICYLIC ACID
RARECHEM AL BO 0025
2,3-Cresotic acid
2,3-cresoticacid
2,3-Cresotinic acid
2,3-cresotinicacid
2-hydroxy-3-methyl-benzoicaci
2-methylsalicylicacid
3-Methylsalycilic acid
3-MS
Acido 3-ossi-5-metil-benzoico
Acido ortocresotinico
acido3-ossi-5-metil-benzoico
acidoortocresotinico
[EINECS(EC#)]

209-447-8
[Molecular Formula]

C8H8O3
[MDL Number]

MFCD00002431
[Molecular Weight]

152.15
[MOL File]

83-40-9.mol
Chemical PropertiesBack Directory
[Appearance]

White To Slightly Reddish Crystalline Solid
[Melting point ]

163-165 °C (lit.)
[Boiling point ]

234.6°C (rough estimate)
[density ]

1.2143 (rough estimate)
[vapor pressure ]

0.065-0.307Pa at 25℃
[refractive index ]

1.4945 (estimate)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

methanol: soluble5%, clear to slightly hazy (colorlessto faint brown)
[form ]

Fine Powder
[pka]

pK1:2.99 (25°C)
[color ]

Almost white
[PH]

2.8 (1.5g/l, H2O, 20℃)
[Water Solubility ]

1.5 g/L (20 ºC)
[Usage]

Toxicity is similar to salicylic acid. Used in manufacturing of dyes
[Detection Methods]

T,NMR
[Merck ]

14,2581
[BRN ]

2086811
[InChIKey]

WHSXTWFYRGOBGO-UHFFFAOYSA-N
[LogP]

2.79-2.86
[CAS DataBase Reference]

83-40-9(CAS DataBase Reference)
[NIST Chemistry Reference]

Hydroxytoluic acid(83-40-9)
[EPA Substance Registry System]

83-40-9(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R37/38:Irritating to respiratory system and skin .
R41:Risk of serious damage to eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/39:Wear suitable protective clothing and eye/face protection .
S22:Do not breathe dust .
[RIDADR ]

UN 2811
[WGK Germany ]

3
[RTECS ]

BZ4385000
[TSCA ]

Yes
[HS Code ]

29182990
[Toxicity]

LD50 oral in rat: 445mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

o-Cresol
[Preparation Products]

Chromeazurol B-->o-Anisic acid-->2-METHOXY-3-METHYLBENZOIC ACID-->NSC 46633-->2-Hydroxy-5-[[4-[(4-hydroxy-3-nitro-5-sodiosulfophenyl)azo]-5-methyl-2-methoxyphenyl]azo]-3-methylbenzoic acid sodium salt-->DIRECT ORANGE 1-->Mordant Violet 1-->5,5'-[4-(dimethylamino)benzylidene]bis(3-methylsalicylic) acid-->5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(dimethylamino)phenyl]methyl]-3-methylsalicylic acid-->5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-[(4-tolyl)amino]phenyl]methyl]-3-methylsalicylic acid-->DIRECT ORANGE 6-->disodium 5-[[4'-[(1-amino-4-sulphonato-2-naphthyl)azo][1,1'-biphenyl]-4-yl]azo]salicylate-->disodium 5-[[4'-[[2,6-diamino-3-methyl-5-[(4-sulphonatophenyl)azo]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-3-methylsalicylate-->5,5'-[(3-Carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bis[2-hydroxy-3-methylbenzoic acid]-->5-[(3-Carboxy-4-hydroxyphenyl)(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-2-hydroxy-3-methylbenzoic acid-->5-[(2-Chloro-4-nitrophenyl)[3-methyl-4-oxo-5-(sodiooxycarbonyl)-2,5-cyclohexadien-1-ylidene]methyl]-2-hydroxy-3-methylbenzoic acid sodium salt-->3-[(3-Carboxy-4-hydroxy-5-methylphenyl)(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]-6-hydroxy-2,4-dimethylbenzoic acid-->C.I. Direct red 59
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Hydroxytoluic acid(83-40-9).msds
Hazard InformationBack Directory
[Chemical Properties]

White To Slightly Reddish Crystalline Solid
[Uses]

3-Methylsalicylic acid is used in manufacture of dyes.
[Uses]

analgesic, antiseptic
[Uses]

Toxicity is similar to salicylic acid. Used in manufacturing of dyes
[Definition]

ChEBI: A monohydroxybenzoic acid consisting of salicylic acid carrying a methyl group at the 3-position.
[Synthesis Reference(s)]

Synthesis, p. 758, 1984 DOI: 10.1055/s-1984-30960
[General Description]

3-Methylsalicylic acid reacts with WOCl4 to yield tungsten(VI) oxo-salicylate complexes.
[Purification Methods]

Crystallise the acid from water. [Beilstein 10 H 220, 10 II 131, 10 III 505, 10 IV 601.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-Methylsalicylic acid(83-40-9)MS
3-Methylsalicylic acid(83-40-9)1HNMR
3-Methylsalicylic acid(83-40-9)13CNMR
3-Methylsalicylic acid(83-40-9)IR1
3-Methylsalicylic acid(83-40-9)IR2
3-Methylsalicylic acid(83-40-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Methylsalicylic acid, 99%(83-40-9)
[Alfa Aesar]

3-Methylsalicylic acid, 99%(83-40-9)
[Sigma Aldrich]

83-40-9(sigmaaldrich)
[TCI AMERICA]

3-Methylsalicylic Acid,>98.0%(GC)(T)(83-40-9)
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