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Home > Encyclopedia > 1-(Cyclopropylmethyl)-4-methoxybenzene

1-(Cyclopropylmethyl)-4-methoxybenzene

1-(Cyclopropylmethyl)-4-methoxybenzene structure

1-(Cyclopropylmethyl)-4-methoxybenzene 

structure
  • CAS No:

    16510-27-3

  • Formula:

    C11H14O

  • Chemical Name:

    1-(Cyclopropylmethyl)-4-methoxybenzene

  • Synonyms:

    Benzene,1-(cyclopropylmethyl)-4-methoxy-;Anisole,p-(cyclopropylmethyl)-;1-(Cyclopropylmethyl)-4-methoxybenzene;Toscanol;(4-Methoxybenzyl)cyclopropane

Description

1-(Cyclopropylmethyl)-4-methoxybenzene has a powerful, anise-like, sweet–spicy note reminding estragole. It is obtained from estragole by Simmons–Smith cyclopropanation.


Clear colourless liquid, Anise-like sweet, spicy aroma

1-(Cyclopropylmethyl)-4-methoxybenzene Basic Attributes

162.232

162.23

444-110-0

B5O4EJ2WVY

DTXSID1051773

2909309090

Characteristics

9.2

2.64770

1.042±0.06 g/cm3(Predicted)

112-113 °C @ Press: 12 Torr

101.5ºC

1.551

Practically insoluble to insoluble|Soluble (in ethanol)

Safety Information

P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P310, P321, P333+P313, P337+P313, P363, P391, P501

H317

|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, P391, and P501|Aggregated GHS information provided by 1289 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Danger|P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P310, P321, P333+P313, P337+P313, P363, P391, and P501|Aggregated GHS information provided by 210 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-(Cyclopropylmethyl)-4-methoxybenzene Use and Manufacturing

Benzene, 1-(cyclopropylmethyl)-4-methoxy-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT;|Flavoring Agents

Computed Properties

Molecular Weight:162.23
XLogP3:3.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:162.104465066
Monoisotopic Mass:162.104465066
Topological Polar Surface Area:9.2
Heavy Atom Count:12
Complexity:132
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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