| Identification | More | [Name]
N-HEPTYLBENZENE | [CAS]
1078-71-3 | [Synonyms]
1-PHENYLHEPTAN
1-PHENYLHEPTANE
HEPTYLBENZENE
LABOTEST-BB LT00159055
N-HEPTYLBENZENE
PHENYLHEPTANE
Benzene, heptyl-
benzene,heptyl-
Heptane, 1(or 7)-phenyl-
Heptane, 1-phenyl-
heptane,1-phenyl-
heptyl-benzen
n-heptbenzene
1-PHENYLHEPTANE, STANDARD FOR GC
n-Peptylbenzene | [EINECS(EC#)]
214-084-3 | [Molecular Formula]
C13H20 | [MDL Number]
MFCD00009545 | [Molecular Weight]
176.3 | [MOL File]
1078-71-3.mol |
| Chemical Properties | Back Directory | [Appearance]
colourless liquid | [Melting point ]
−48 °C(lit.) | [Boiling point ]
233 °C(lit.) | [density ]
0.86 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.485(lit.)
| [Fp ]
203 °F
| [storage temp. ]
Store at room temperature | [form ]
clear liquid | [color ]
Colorless to Almost colorless | [Specific Gravity]
0.860 | [Stability:]
Stable. Incompatible with strong oxidizing agents. Combustible. | [BRN ]
1905782 | [InChI]
1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3 | [InChIKey]
LBNXAWYDQUGHGX-UHFFFAOYSA-N | [SMILES]
CCCCCCCc1ccccc1 | [CAS DataBase Reference]
1078-71-3(CAS DataBase Reference) | [NIST Chemistry Reference]
n-Heptylbenzene(1078-71-3) | [EPA Substance Registry System]
1078-71-3(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
N | [Risk Statements ]
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment . | [Safety Statements ]
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S60:This material and/or its container must be disposed of as hazardous waste . | [RIDADR ]
UN 3082 9/PG 3
| [WGK Germany ]
3
| [TSCA ]
Yes | [HazardClass ]
9 | [PackingGroup ]
III | [HS Code ]
29029090 | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Aquatic Acute 1
Aquatic Chronic 1 |
| Hazard Information | Back Directory | [Chemical Properties]
colourless liquid | [Uses]
1-Phenylheptane is used in zirconia and titania based stationary phase capillary HTLC, to separate alkyl benzene derivatives using an acetonitrile-water eluent. | [Definition]
ChEBI: 1-Phenylheptane is a member of benzenes. | [Synthesis Reference(s)]
Tetrahedron Letters, 27, p. 3239, 1986 DOI: 10.1016/S0040-4039(00)84763-2 | [General Description]
Heptylbenzene (1-Phenylheptane) forms charge-transfer complexes with fluoranil and 1,3,5-trinitrobenzene. |
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