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1-Butoxy-4-ethynylbenzene

1-Butoxy-4-ethynylbenzene structure

CAS No:
79887-15-3
Formula:
C12H14O
Chemical Name:
1-Butoxy-4-ethynylbenzene
Synonyms:
Benzene,1-butoxy-4-ethynyl-;1-Butoxy-4-ethynylbenzene;(4-Butoxyphenyl)acetylene;4-Butyloxyphenylacetylene;1-Ethynyl-4-butoxybenzene;1-Butoxy-4-eth-1-ynylbenzene

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1-Butoxy-4-ethynylbenzene Basic Attributes

Molecular Weight：

174.24

Exact Mass：

174.24

DSSTox ID：

DTXSID70379396

HScode：

2909309090

Characteristics

PSA：

9.2

XLogP3：

2.84680

Density：

0.97g/cm3

Boiling Point：

252.9ºC at 760 mmHg

Flash Point：

100.5ºC

Refractive Index：

1.514

Safety Information

safety instructions：

24/25

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:174.24
XLogP3:3.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:174.104465066
Monoisotopic Mass:174.104465066
Topological Polar Surface Area:9.2
Heavy Atom Count:13
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Butoxy-4-ethynylbenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-Butoxy-4-ethynylbenzene

SDS

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