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Substance Name: 2,5-Xylidine
RN: 95-78-3
UNII: XWK0W8DA04
InChIKey: VOWZNBNDMFLQGM-UHFFFAOYSA-N

Molecular Formula

  • C8-H11-N

Molecular Weight

  • 121.182
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Code

  • Overall Carcinogenic Evaluation: Group 3
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Names and Synonyms

Name of Substance

  • 2,5-Xylidene
  • 2,5-Xylidine

Synonyms

  • 1-Amino-2,5-dimethylbenzene
  • 2,5-Dimethylaniline
  • 2,5-Dimethylbenzenamine
  • 2,5-Dimethylphenylamine
  • 2,5-Xylidine
  • 2-Amino-1,4-xylene
  • 3-Amino-1,4-dimethylbenzene
  • 5-Amino-1,4-dimethylbenzene
  • 5-Methyl-o-toluidine
  • 6-Methyl-m-toluidine
  • AI3-16559
  • Aniline, 2,5-dimethyl-
  • Benzenamine, 2,5-dimethyl-
  • Benzene, 2-amino-1,4-dimethyl-
  • CCRIS 4740
  • EC 202-451-0
  • EINECS 202-451-0
  • HSDB 2093
  • NSC 7639
  • p-Dimethylaniline
  • p-Xylidine
  • para-Xylidine
  • UNII-XWK0W8DA04

Systematic Names

  • 2,5-Xylidine
  • Benzenamine, 2,5-dimethyl-

Superlist Name

  • 2,5-Xylidine

Registry Numbers

CAS Registry Number

  • 95-78-3

FDA UNII

  • XWK0W8DA04

Related Registry Number

  • 51786-53-9 (hydrochloride)

System Generated Number

  • 0000095783

Structure Descriptors

InChI

1S/C8H11N/c1-6-3-4-7(2)8(9)5-6/h3-5H,9H2,1-2H3

InChIKey

VOWZNBNDMFLQGM-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)C)C)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 841mg/kg (841mg/kg)   National Technical Information Service. Vol. PB214-270,
rat LD50 oral 1297mg/kg (1297mg/kg)   National Technical Information Service. Vol. PB214-270,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 15.5 deg C   EXP
Boiling Point 214 deg C   EXP
pKa Dissociation Constant 4.53 (none) 25 EXP
log P (octanol-water) 1.83 (none)   EXP
Water Solubility 5600 mg/L 12 EXP
Vapor Pressure 0.15 mm Hg 20 EXP
Henry's Law Constant 4.27E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.00E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.