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Substance Name: 4-Methyl-1-phenylpentan-1-one
RN: 2050-07-9
InChIKey: WRJZDDJYWWJLIS-UHFFFAOYSA-N

Molecular Formula

  • C12-H16-O

Molecular Weight

  • 176.257
 
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Names and Synonyms

Synonym

  • EINECS 218-079-7

Systematic Name

  • 4-Methyl-1-phenylpentan-1-one

Registry Numbers

CAS Registry Number

  • 2050-07-9

System Generated Number

  • 0002050079

Structure Descriptors

InChI

1S/C12H16O/c1-10(2)8-9-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

InChIKey

WRJZDDJYWWJLIS-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(=O)CCC(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -2.00E+00 deg C   EXP
Boiling Point 255.5 deg C   EXP
log P (octanol-water) 3.690 (none)   EST
Atmospheric OH Rate Constant 1.14E-11 cm3/molecule-sec 25 EST

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