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2-Butylbenzofuran

2-Butylbenzofuran structure

CAS No:
4265-27-4
Formula:
C12H14O
Chemical Name:
2-Butylbenzofuran
Synonyms:
Benzofuran,2-butyl-;2-Butylbenzofuran;2-Butylbenzo[b]furan;2-Butyl-1-benzofuran;2-(n-Butyl)benzofuran
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-Butylbenzofuran Basic Attributes

Molecular Weight：

174.243

Exact Mass：

174.24

EC Number：

224-250-7

DSSTox ID：

DTXSID90195378

HScode：

2932999099

Characteristics

PSA：

13.1

XLogP3：

4.72

Appearance：

pale yellow

Density：

1.0±0.1 g/cm3

Boiling Point：

129 °C @ Press: 15 Torr

Flash Point：

101.1±0.0 °C

Refractive Index：

1.554

Safety Information

safety instructions：

S24/25

Precautionary statement(s)：

P273, P501

Hazard Statements：

H413

GHS Classification：

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 44 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:174.24
XLogP3:4.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:174.104465066
Monoisotopic Mass:174.104465066
Topological Polar Surface Area:13.1
Heavy Atom Count:13
Complexity:155
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Butylbenzofuran

CAS No.: 4265-27-4

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