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Heptylcyclohexane

Heptylcyclohexane structure

CAS No:
5617-41-4
Formula:
C13H26
Chemical Name:
Heptylcyclohexane
Synonyms:
Cyclohexane,heptyl-;Heptane,1-cyclohexyl-;Heptylcyclohexane;n-Heptylcyclohexane;1-Cyclohexylheptane;NSC 102802
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Heptylcyclohexane Basic Attributes

Molecular Weight：

182.35

Exact Mass：

182.35

EC Number：

227-041-9

NSC Number：

102802

DSSTox ID：

DTXSID1058636

Characteristics

PSA：

XLogP3：

7.07

Density：

0.8124 g/cm³ @ Temp: 20 °C

Melting Point：

-30 °C

Boiling Point：

244 °C

Flash Point：

93.2±10.6 °C

Refractive Index：

1.444

Vapor Pressure：

0.04 mmHg

Safety Information

safety instructions：

S22-S24/25

Precautionary statement(s)：

P264, P270, P273, P280, P301+P312, P305+P351+P338, P330, P337+P313, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Biological Half-Life：

1.48 Days

Heptylcyclohexane Use and Manufacturing

Manufacturing Info：

Cyclohexane, heptyl-: INACTIVE

Computed Properties

Molecular Weight:182.35
XLogP3:6.8
Rotatable Bond Count:6
Exact Mass:182.203450829
Monoisotopic Mass:182.203450829
Heavy Atom Count:13
Complexity:101
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes