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Substance Name: Heptanophenone
RN: 1671-75-6
UNII: KX07WP06JY
InChIKey: UXMQORVHJMUQFD-UHFFFAOYSA-N

Molecular Formula

  • C13-H18-O

Molecular Weight

  • 190.284
 
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Names and Synonyms

Name of Substance

  • Heptanophenone

Synonyms

  • 1-Heptanone, 1-phenyl-
  • EINECS 216-802-0
  • Heptanophenone
  • UNII-KX07WP06JY

Systematic Names

  • 1-Heptanone, 1-phenyl-
  • 1-Phenylheptan-1-one

Registry Numbers

CAS Registry Number

  • 1671-75-6

FDA UNII

  • KX07WP06JY

System Generated Number

  • 0001671756

Structure Descriptors

InChI

1S/C13H18O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

InChIKey

UXMQORVHJMUQFD-UHFFFAOYSA-N

Smiles

O=C(c1ccccc1)CCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 16.4 deg C   EXP
Boiling Point 283.3 deg C   EXP
log P (octanol-water) 4.130 (none)   EST
Atmospheric OH Rate Constant 1.13E-11 cm3/molecule-sec 25 EST

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