2,5-Dimethylterephthalic acid

Name: 2,5-Dimethylterephthalic acid
SKU: ACM6051667-2
Rating: 5 (1 reviews)

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Catalog NumberACM6051667-2

CAS Number6051-66-7

CategoryMonomers; Polymers

Synonyms

2,5-Dimethyl-1,4-benzenedicarboxylic acid; 2,5-dimethylbenzene-1,4-dicarboxylic acid

IUPAC Name

2,5-dimethylterephthalic acid

Molecular Weight

194.18

Molecular Formula

C10H10O4

Canonical SMILES

CC1=CC(=C(C=C1C(=O)O)C)C(=O)O

InChI

InChI=1S/C10H10O4/c1-5-3-8(10(13)14)6(2)4-7(5)9(11)12/h3-4H,1-2H3,(H,11,12)(H,13,14)

InChI Key

FKUJGZJNDUGCFU-UHFFFAOYSA-N

Boiling Point

386.8±30.0 °C(Predicted)

Melting Point

283 °C (dec.)

Purity

98%

Density

1.320±0.06 g/cm3(Predicted)

Appearance

White solid

Complexity

223

Covalently-Bonded Unit Count

Exact Mass

194.057909g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00020292

Monoisotopic Mass

194.057909g/mol

NSC Number

174018

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Rotatable Bond Count

Signal Word

Warning

XLogP3

1.7

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