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Substance Name: Benzene-1,3-bis(acetyl)
RN: 6781-42-6
InChIKey: VCHOFVSNWYPAEF-UHFFFAOYSA-N

Molecular Formula

  • C10-H10-O2

Molecular Weight

  • 162.187
 
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Names and Synonyms

Synonym

  • EINECS 229-842-9

Systematic Name

  • Benzene-1,3-bis(acetyl)

Registry Numbers

CAS Registry Number

  • 6781-42-6

System Generated Number

  • 0006781426

Structure Descriptors

InChI

1S/C10H10O2/c1-7(11)9-4-3-5-10(6-9)8(2)12/h3-6H,1-2H3

InChIKey

VCHOFVSNWYPAEF-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)C(C)=O)C(C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 32 deg C   EXP
log P (octanol-water) 1.43 (none)   EXP
Water Solubility 4020 mg/L 25 EST
Vapor Pressure 7.23E-03 mm Hg 25 EST
Henry's Law Constant 1.79E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.82E-12 cm3/molecule-sec 25 EST

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